SCHEMBL3202594

SCHEMBL3202594

NCCc1cc(=O)oc2c3c4c(cc12)CCCN4CCC3

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 11/20 0.61
▸ ALDH1A1 P00352 10/20 0.61
▸ MEN1 O00255 9/20 0.61
▸ USP2 O75604 7/20 0.61
▸ KDM4E B2RXH2 7/20 0.61
▸ MAPT P10636 6/20 0.61
▸ GAA P10253 6/20 0.61
▸ LMNA P02545 5/20 0.61
▸ HPGD P15428 4/20 0.61
▸ HSD17B10 Q99714 4/20 0.61
▸ CASP1 P29466 4/20 0.61
▸ CASP7 P55210 4/20 0.61
▸ TDP1 Q9NUW8 3/20 0.61
▸ GLA P06280 2/20 0.61
▸ ATM Q13315 2/20 0.61
▸ L3MBTL1 Q9Y468 2/20 0.61
▸ HTT P42858 2/20 0.61
▸ KEAP1 Q14145 1/20 0.61
▸ NFE2L2 Q16236 1/20 0.61
▸ GPR35 Q9HC97 1/20 0.61

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL31718750 0.99 KMT2A (0.60) KMT2AALDH1A1MEN1USP2KDM4E
SCHEMBL14303297 0.90 ALDH1A1 (0.63) KMT2AALDH1A1MEN1USP2KDM4E
Trifluoroacetic Acid SCHEMBL29634900 0.90 KMT2A (0.59) KMT2AALDH1A1MEN1USP2KDM4E
SCHEMBL24623305 0.88 ALDH1A1 (0.64) KMT2AALDH1A1MEN1USP2KDM4E
SCHEMBL903151 0.86 ALDH1A1 (0.68) KMT2AALDH1A1MEN1USP2KDM4E
SCHEMBL1213320 0.85 KMT2A (0.63) KMT2AALDH1A1MEN1USP2KDM4E
SCHEMBL1212238 0.85 ALDH1A1 (0.63) KMT2AALDH1A1MEN1USP2KDM4E
SCHEMBL1212937 0.85 ALDH1A1 (0.67) KMT2AALDH1A1MEN1USP2KDM4E
SCHEMBL12892379 0.85 ALDH1A1 (0.63) KMT2AALDH1A1MEN1USP2KDM4E
SCHEMBL14303304 0.85 KMT2A (0.60) KMT2AALDH1A1MEN1USP2KDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025096017-A2 VESICULAR NEUROTRANSMITTER LEAKAGE ASSAY THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2025-05-08 — — WO disclosed
CN-116940348-A Meckel cell activator, enhancer for synaptic vesicle, neurotransmitter release promoter, method for evaluating neurotransmitter release activity of Meckel cell, and method for screening neurotransmitter release promoter of Meckel cell 株式会社资生堂 2023-10-24 — — CN disclosed
WO-2022202714-A1 MERKEL CELL ACTIVATOR, SYNAPTIC VESICLE ENHANCER, NEUROTRANSMITTER RELEASE ACCELERATOR, METHOD FOR ASSESSING NEUROTRANSMITTER RELEASE ACTIVITY OF MERKEL CELLS, AND METHOD FOR SCREENING FOR NEUROTRANSMITTER RELEASE ACCELERATOR FOR MERKEL CELLS 株式会社 資生堂 2022-09-29 — — WO disclosed
US-20220218722-A1 COUMARIN-MODIFIED ANDROGENS FOR THE TREATMENT OF PROSTATE CANCER UNIVERSITY OF KENTUCKY RESEARCH FOUNDATION 2022-07-14 — — US disclosed
WO-2020223174-A1 COUMARIN-MODIFIED ANDROGENS FOR THE TREATMENT OF PROSTATE CANCER HEALTH RESEARCH, INC. (US) 2020-11-05 — — WO disclosed
WO-2020032080-A1 COMPOUND, SALT OF COMPOUND, NEUROMODULATION AGENT, METHOD FOR EVALUATING NEUROMODULATION AGENT, METHOD FOR PRODUCING COMPOUND, AND METHOD FOR PRODUCING SALT OF COMPOUND 学校法人慶應義塾 2020-02-13 — — WO disclosed
US-20190175557-A1 COMPOUNDS USEFUL FOR DECREASING INTERFERON LEVEL UNIVERSITÉ PARIS CITÉ (FR) 2019-06-13 — — US disclosed
US-9075014-B2 pH-responsive fluorescent false neurotransmitters and their use THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2015-07-07 — — US disclosed
US-20130190497-A1 FLUORESCENT SUBSTRATES FOR MONOAMINE TRANSPORTERS AS OPTICAL FALSE NEUROTRANSMITTERS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2013-07-25 — — US disclosed
US-20130190497-A1 FLUORESCENT SUBSTRATES FOR MONOAMINE TRANSPORTERS AS OPTICAL FALSE NEUROTRANSMITTERS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2013-07-25 — — US disclosed
US-20130190497-A1 FLUORESCENT SUBSTRATES FOR MONOAMINE TRANSPORTERS AS OPTICAL FALSE NEUROTRANSMITTERS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2013-07-25 — — US disclosed
US-20130171664-A1 PH-RESPONSIVE FLUORESCENT FALSE NEUROTRANSMITTERS AND THEIR USE THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK 2013-07-04 — — US disclosed
US-8337941-B2 Fluorescent substrates for monoamine transporters as optical false neurotransmitters THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2012-12-25 — — US disclosed
US-8337941-B2 Fluorescent substrates for monoamine transporters as optical false neurotransmitters THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2012-12-25 — — US disclosed
US-8337941-B2 Fluorescent substrates for monoamine transporters as optical false neurotransmitters THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2012-12-25 — — US disclosed
US-20100035279-A1 Fluorescent Substrates for Monoamine Transporters as Optical False Neurotransmitters NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-02-11 — — US disclosed
US-20100035279-A1 Fluorescent Substrates for Monoamine Transporters as Optical False Neurotransmitters NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-02-11 — — US disclosed
US-20100035279-A1 Fluorescent Substrates for Monoamine Transporters as Optical False Neurotransmitters NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-02-11 — — US disclosed
WO-2008013997-A2 FLUORESCENT SUBSTRATES FOR MONOAMINE TRANSPORTERS AS OPTICAL FALSE NEUROTRANSMITTERS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2008-01-31 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100035279-A1 Fluorescent Substrates for Monoamine Transporters as Optical False Neurotransmitters SLC18A2, SLC6A2, SLC18A3 KMT2A 2665/4885ALDH1A1 904/4885MEN1 3095/4885
US-20130190497-A1 FLUORESCENT SUBSTRATES FOR MONOAMINE TRANSPORTERS AS OPTICAL FALSE NEUROTRANSMITTERS SLC18A2, SLC6A2, SLC18A3 KMT2A 2665/4885ALDH1A1 904/4885MEN1 3095/4885
US-20190175557-A1 COMPOUNDS USEFUL FOR DECREASING INTERFERON LEVEL IFNAR1, CXCR4, CXCR3 KMT2A 4438/4885ALDH1A1 2218/4885MEN1 4026/4885
US-20220218722-A1 COUMARIN-MODIFIED ANDROGENS FOR THE TREATMENT OF PROSTATE CANCER AR, SHBG, NCOA1 KMT2A 4466/4885ALDH1A1 1280/4885MEN1 1515/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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