SCHEMBL4126571

SCHEMBL4126571

CN(C)CCN(C)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.50
HTR2A P28223 2/20 0.46
HRH1 P35367 2/20 0.46
CA12 O43570 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
TNNI3 P19429 1/20 0.43
TNNT2 P45379 1/20 0.43
TNNC1 P63316 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL11501575 0.93 KMT2A (0.48) TAAR1HTR2AHRH1CA12CA2
SCHEMBL11044440 0.92 CA12 (0.50) TAAR1HTR2AHRH1CA12CA2
SCHEMBL21448012 0.86 HTR2A (0.50) TAAR1HTR2AHRH1CA12CA2
SCHEMBL2467097 0.83 TDP1 (0.46) TAAR1HTR2AHRH1CA12CA2
SCHEMBL23504663 0.83 CA12 (0.44) TAAR1CA12CA2CA9MEN1
SCHEMBL11145951 0.82 CA12 (0.47) TAAR1CA12CA2CA9MEN1
SCHEMBL13645984 0.82 SIGMAR1 (0.48) TAAR1CA12CA2CA9MEN1
Hydrochloric Acid SCHEMBL28327279 0.81 TDP1 (0.43) TAAR1HTR2AHRH1CA12CA2
SCHEMBL17037834 0.80 SIGMAR1 (0.52) TAAR1CA12CA2CA9SIGMAR1
SCHEMBL11501576 0.80 TAAR1 (0.50) TAAR1HTR2AHRH1MEN1KMT2A

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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030060658-A1 Process for preparing sorbic acid by thermal cleavage NUTRINOVA NUTRITION SPECIALTIES & FOOD INGREDIENTS GMBH (DE) 2003-03-27 US claimed
US-20230174485-A1 LIPOXYGENASE INHIBITORS SRI INTERNATIONAL (US) 2023-06-08 US disclosed
US-20230118462-A1 Process for Making Sorbic Acid from Renewable Materials NUTRINOVA NETHERLANDS B.V. (NL) 2023-04-20 US disclosed
WO-2023059603-A2 A PROCESS FOR MAKING SORBIC ACID FROM RENEWABLE MATERIALS CELANESE INTERNATIONAL CORPORATION (US) 2023-04-13 WO disclosed
US-11345711-B2 8,9-dihydroimidazo[1,2-a]pyrimido[5,4-e]pyrimidin-5(6H)-ones Impact Therapeutics (Shanghai), Inc (CN) 2022-05-31 US disclosed
US-20200385394-A1 8,9-DIHYDROIMIDAZO[1,2-a]PYRIMIDO[5,4-e]PYRIMIDIN-5(6H)-ONES Impact Therapeutics (Shanghai), Inc (CN) 2020-12-10 US disclosed
US-10703759-B2 8,9-dihydroimidazo[1,2-a]pyrimido[5,4-e]pyrimidin-5(6H)-ones IMPACT THERAPEUTICS, INC (CN) 2020-07-07 US disclosed
US-20190308984-A1 8,9-DIHYDROIMIDAZO[1,2-a]PYRIMIDO[5,4-e]PYRIMIDIN-5(6H)-ONES Impact Therapeutics (Shanghai), Inc (CN) 2019-10-10 US disclosed
US-9911931-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2018-03-06 US disclosed
US-9790499-B2 Functionally-modified oligonucleotides and subunits thereof SAREPTA THERAPEUTICS, INC. (US) 2017-10-17 US disclosed
EP-1325902-A1 Process for the preparation of sorbic acid Nutrinova Nutrition Specialties & Food Ingredients GmbH (DE) 2003-07-09 EP disclosed
US-20030060658-A1 Process for preparing sorbic acid by thermal cleavage NUTRINOVA NUTRITION SPECIALTIES & FOOD INGREDIENTS GMBH (DE) 2003-03-27 US disclosed
EP-1295860-A2 Process for the preparation of sorbic acid by thermal decomposition Nutrinova Nutrition Specialties & Food Ingredients GmbH (DE) 2003-03-26 EP disclosed
US-4898941-A Process for preparing diphenylalkene derivatives KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1990-02-06 US disclosed
US-4446039-A Organic compositions containing hydroxy-aromatic compounds useful as additives for fuels and lubricants THE LUBRIZOL CORPORATION (US) 1984-05-01 US disclosed
US-4369310-A PHOTOGRAPHIC DYES CIBA-GEIGY LTD. (CH) 1983-01-18 US disclosed
EP-0029412-A2 Bleachable dyestuffs, process for their preparation and their use in photographic material CIBA-GEIGY AG (CH) 1981-05-27 EP disclosed
US-4147643-A REACTION PRODUCT OF PHENOL, FORMALDEHYDE, AND A CHLORO-PHENOL MODIFIED POLYOLEFIN THE LUBRIZOL CORPORATION (US) 1979-04-03 US disclosed
US-4119622-A Pyrazolonylazoaniline or aminonaphtyl compounds for copying processes BASF AKTIENGESELLSCHAFT (DE) 1978-10-10 US disclosed
US-4101541-A DYES FOR POLYESTERS OR POLYPROPYLENE CIBA-GEIGY CORPORATION (US) 1978-07-18 US 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 (6 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-20230118462-A1 Process for Making Sorbic Acid from Renewable Materials BCKDK, ALKBH3, MCCC2 TAAR1 2608/4885HTR2A 3542/4885HRH1 1514/4885
US-20190308984-A1 8,9-DIHYDROIMIDAZO[1,2-a]PYRIMIDO[5,4-e]PYRIMIDIN-5(6H)-ONES WEE1, WEE2, CCNE1 TAAR1 3639/4885HTR2A 3985/4885HRH1 1197/4885
US-11345711-B2 8,9-dihydroimidazo[1,2-a]pyrimido[5,4-e]pyrimidin-5(6H)-ones WEE1, WEE2, CCNE1 TAAR1 3639/4885HTR2A 3985/4885HRH1 1197/4885
US-20230174485-A1 LIPOXYGENASE INHIBITORS ALOX15B, ALOX12, ALOX15 TAAR1 2643/4885HTR2A 826/4885HRH1 2397/4885
US-10703759-B2 8,9-dihydroimidazo[1,2-a]pyrimido[5,4-e]pyrimidin-5(6H)-ones WEE1, WEE2, CCNE1 TAAR1 3639/4885HTR2A 3985/4885HRH1 1197/4885
US-20200385394-A1 8,9-DIHYDROIMIDAZO[1,2-a]PYRIMIDO[5,4-e]PYRIMIDIN-5(6H)-ONES WEE1, WEE2, CCNE1 TAAR1 3639/4885HTR2A 3985/4885HRH1 1197/4885

“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.