SCHEMBL17602116

SCHEMBL17602116

CN(C)c1ccc(N(C)c2ccc(Oc3ccccn3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.43
PTGS2 P35354 1/20 0.43
MAOA P21397 3/20 0.43
MAOB P27338 3/20 0.43
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
GAA P10253 1/20 0.41
PDE10A Q9Y233 1/20 0.40
KDM4C Q9H3R0 3/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
KDM4E B2RXH2 2/20 0.39
MITF O75030 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
TP53 P04637 1/20 0.39
APP P05067 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL17602080 0.92 LTA4H (0.44) LTA4HPTGS2PDE10AKDM4CMEN1
SCHEMBL17602142 0.91 KDM4C (0.47) LTA4HPTGS2PDE10AKDM4CKDM4E
SCHEMBL17609153 0.89 NPC1 (0.45) LTA4HPTGS2NPC1RAB9AMEN1
SCHEMBL17609125 0.89 MEN1 (0.45) LTA4HPTGS2NPC1RAB9AGAA
SCHEMBL17602309 0.88 MAPK1 (0.48) LTA4HPTGS2RAB9AKDM4CMEN1
SCHEMBL17609138 0.86 KDM4C (0.50) LTA4HPTGS2GAAPDE10AKDM4C
SCHEMBL17602209 0.85 KDM4C (0.44) LTA4HPTGS2NPC1RAB9APDE10A
SCHEMBL17602207 0.85 RAB9A (0.48) LTA4HPTGS2NPC1RAB9APDE10A
SCHEMBL17602210 0.85 KAT2B (0.45) LTA4HPTGS2NPC1RAB9AGAA
SCHEMBL17602047 0.85 KDM4C (0.44) LTA4HPTGS2NPC1RAB9AGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11535616-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC (US) 2022-12-27 US disclosed
US-20210009585-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2021-01-14 US disclosed
US-10208039-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2019-02-19 US disclosed
US-10202381-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2019-02-12 US disclosed
US-20180297999-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2018-10-18 US disclosed
US-10030017-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2018-07-24 US disclosed
US-20180162857-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2018-06-14 US disclosed
US-9643965-B2 Histone demethylase inhibitors Celgene Quantical Research, Inc. (US) 2017-05-09 US disclosed
US-20160194323-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. 2016-07-07 US disclosed
US-20160083379-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. 2016-03-24 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 (9 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-20160194323-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5C, KDM1A LTA4H 1516/4885PTGS2 1782/4885MAOA 517/4885
US-10030017-B2 Histone demethylase inhibitors KDM1B, KDM5C, KDM1A LTA4H 1516/4885PTGS2 1782/4885MAOA 517/4885
US-20160083379-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM5C LTA4H 1543/4885PTGS2 1797/4885MAOA 497/4885
US-11535616-B2 Histone demethylase inhibitors KDM1B, KDM1A, KDM5C LTA4H 1543/4885PTGS2 1797/4885MAOA 497/4885
US-20180162857-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5C, KDM1A LTA4H 1516/4885PTGS2 1782/4885MAOA 517/4885
US-20180297999-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM5C, KDM1A LTA4H 1516/4885PTGS2 1782/4885MAOA 517/4885
US-10202381-B2 Histone demethylase inhibitors KDM1B, KDM5C, KDM1A LTA4H 1516/4885PTGS2 1782/4885MAOA 517/4885
US-20210009585-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM5C LTA4H 1543/4885PTGS2 1797/4885MAOA 497/4885
US-10208039-B2 Histone demethylase inhibitors KDM1B, KDM5C, KDM1A LTA4H 1516/4885PTGS2 1782/4885MAOA 517/4885

“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.