SCHEMBL16296987

SCHEMBL16296987

COc1ccc(NC2=C(N3CCN(C(C)C)CC3)C(=O)c3ccccc3C2=O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 14/20 0.56
▸ ALDH1A1 P00352 12/20 0.56
▸ L3MBTL1 Q9Y468 8/20 0.56
▸ SMN1; SMN2 Q16637 7/20 0.56
▸ HTT P42858 7/20 0.56
▸ POLB P06746 6/20 0.56
▸ MAPK1 P28482 6/20 0.56
▸ LMNA P02545 6/20 0.56
▸ HPGD P15428 6/20 0.56
▸ RAB9A P51151 5/20 0.56
▸ KDM4E B2RXH2 5/20 0.56
▸ NSD2 O96028 3/20 0.56
▸ TDP1 Q9NUW8 2/20 0.56
▸ APAF1 O14727 8/20 0.56
▸ NPC1 O15118 4/20 0.56
▸ CDC25A P30304 2/20 0.56
▸ CDC25B P30305 2/20 0.56
▸ MITF O75030 2/20 0.54
▸ KLF5 Q13887 1/20 0.54
▸ PTBP1 P26599 1/20 0.52

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
SCHEMBL16297021 0.88 MAPT (0.59) MAPTALDH1A1L3MBTL1SMN1; SMN2HTT
SCHEMBL7243360 0.88 APAF1 (0.72) MAPTALDH1A1L3MBTL1SMN1; SMN2HTT
SCHEMBL16297222 0.86 APAF1 (0.74) MAPTALDH1A1L3MBTL1SMN1; SMN2HTT
SCHEMBL16296988 0.85 APAF1 (0.58) MAPTALDH1A1L3MBTL1SMN1; SMN2HTT
SCHEMBL16296645 0.85 APAF1 (0.58) MAPTALDH1A1L3MBTL1SMN1; SMN2HTT
SCHEMBL16297001 0.85 APAF1 (0.58) MAPTALDH1A1L3MBTL1SMN1; SMN2HTT
SCHEMBL16296859 0.85 APAF1 (0.58) MAPTALDH1A1L3MBTL1SMN1; SMN2HTT
SCHEMBL16297042 0.80 APAF1 (0.52) MAPTALDH1A1L3MBTL1SMN1; SMN2HTT
SCHEMBL16297072 0.78 APAF1 (0.55) MAPTALDH1A1L3MBTL1SMN1; SMN2HTT
SCHEMBL16296931 0.78 MAPT (0.55) MAPTALDH1A1L3MBTL1SMN1; SMN2HTT

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220128562-A1 BIOMARKERS PREDICTIVE OF CANCER CELL RESPONSE TO ML329 OR A DERIVATIVE THEREOF UNIVERSITY OF KANSAS 2022-04-28 — — US disclosed
US-20170334842-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY UNIVERSITY OF KANSAS 2017-11-23 — — US disclosed
US-20170334842-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY UNIVERSITY OF KANSAS 2017-11-23 — — US disclosed
US-20170334842-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY UNIVERSITY OF KANSAS 2017-11-23 — — US disclosed
US-9745261-B2 Inhibitors of the MITF molecular pathway THE GENERAL HOSPITAL CORPORATION (US) 2017-08-29 — — US disclosed
US-9745261-B2 Inhibitors of the MITF molecular pathway THE GENERAL HOSPITAL CORPORATION (US) 2017-08-29 — — US disclosed
US-9745261-B2 Inhibitors of the MITF molecular pathway THE GENERAL HOSPITAL CORPORATION (US) 2017-08-29 — — US disclosed
US-20160130222-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY THE BROAD INSTITUTE, INC. 2016-05-12 — — US disclosed
US-20160130222-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY THE BROAD INSTITUTE, INC. 2016-05-12 — — US disclosed
US-20160130222-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY THE BROAD INSTITUTE, INC. 2016-05-12 — — US disclosed
EP-3007688-A2 INHIBITORS OF THE MITF MOLECULAR PATHWAY The General Hospital Corporation (US) 2016-04-20 — — EP disclosed
WO-2014201016-A2 INHIBITORS OF THE MITF MOLECULAR PATHWAY THE GENERAL HOSPITAL CORPORATION (US) 2014-12-18 — — WO disclosed
WO-2014201016-A2 INHIBITORS OF THE MITF MOLECULAR PATHWAY THE GENERAL HOSPITAL CORPORATION (US) 2014-12-18 — — 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 (3 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-20160130222-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY MITF, TFEB, TYR MAPT 4100/4885ALDH1A1 2501/4885L3MBTL1 2967/4885
US-20170334842-A1 INHIBITORS OF THE MITF MOLECULAR PATHWAY MITF, TFEB, TYR MAPT 4092/4885ALDH1A1 2444/4885L3MBTL1 2985/4885
US-20220128562-A1 BIOMARKERS PREDICTIVE OF CANCER CELL RESPONSE TO ML329 OR A DERIVATIVE THEREOF NQO1, KEAP1, NFE2L2 MAPT 3766/4885ALDH1A1 287/4885L3MBTL1 475/4885

“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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