SCHEMBL644097

SCHEMBL644097

O=c1c(Cl)nc(Cl)cn1Cc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
BRD4 O60885 4/20 0.55
MAPK14 Q16539 4/20 0.44
LMNA P02545 3/20 0.42
RECQL P46063 1/20 0.42
RAB9A P51151 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
F2 P00734 1/20 0.41
PLG P00747 1/20 0.41
ELANE P08246 1/20 0.41
CTSG P08311 1/20 0.41
CMA1 P23946 1/20 0.41
CTRC Q99895 1/20 0.41
HPGD P15428 1/20 0.41
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40

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
SCHEMBL644390 0.80 MAPT (0.49) LMNAKDM4EMAPTCMA1
SCHEMBL16640633 0.79 BRD4 (0.43) ALDH1A1SMN1; SMN2BRD4MAPK14RAB9A
SCHEMBL3679462 0.77 BRD4 (0.50) ALDH1A1SMN1; SMN2BRD4MAPK14HPGD
SCHEMBL923979 0.74 BRD4 (0.36) ALDH1A1SMN1; SMN2BRD4LMNARAB9A
SCHEMBL14223853 0.72 ALDH1A1 (0.55) ALDH1A1SMN1; SMN2BRD4
SCHEMBL12376830 0.71 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2LMNARAB9AKDM4E
SCHEMBL19924933 0.71 BRD4 (1.00) BRD4
SCHEMBL21553055 0.71 BRD4 (0.54) ALDH1A1SMN1; SMN2BRD4MAPK14LMNA
SCHEMBL7443315 0.70 BRD4 (0.55) ALDH1A1SMN1; SMN2BRD4RECQLMEN1
SCHEMBL25668657 0.70 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2RAB9AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11028066-B2 Inhibitors of lysine specific demethylase-1 CELGENE QUANTICEL RESEARCH, INC. (US) 2021-06-08 US disclosed
US-11028066-B2 Inhibitors of lysine specific demethylase-1 CELGENE QUANTICEL RESEARCH, INC. (US) 2021-06-08 US disclosed
CN-106660987-B Inhibitors of lysine-specific demethylase-1 赛尔基因昆蒂赛尔研究公司 2020-11-06 CN disclosed
US-20200172506-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 CELGENE QUANTICEL RESEARCH, INC. (US) 2020-06-04 US disclosed
US-20200172506-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 CELGENE QUANTICEL RESEARCH, INC. (US) 2020-06-04 US disclosed
EP-3160956-B1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 CELGENE QUANTICEL RES INC (US) 2020-05-27 EP disclosed
EP-3160956-B1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 CELGENE QUANTICEL RES INC (US) 2020-05-27 EP disclosed
US-10597376-B2 Inhibitors of lysine specific demethylase-1 CELGENE QUANTICEL RESEARCH, INC. (US) 2020-03-24 US disclosed
US-10597376-B2 Inhibitors of lysine specific demethylase-1 CELGENE QUANTICEL RESEARCH, INC. (US) 2020-03-24 US disclosed
US-20180273505-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 CELGENE QUANTICEL RESEARCH, INC. (US) 2018-09-27 US disclosed
WO-2008155069-A2 SUBSTITUTED OXAZOLIDINONES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-12-24 WO disclosed
EP-1931669-A1 KINASE INHIBITORS Takeda San Diego, Inc. (US) 2008-06-18 EP disclosed
WO-2008054956-A2 KINASE INHIBITORS TAKEDA SAN DIEGO, INC. (US) 2008-05-08 WO disclosed
WO-2008054956-A2 KINASE INHIBITORS TAKEDA SAN DIEGO, INC. (US) 2008-05-08 WO disclosed
WO-2008045834-A2 KINASE INHIBITORS TAKEDA SAN DIEGO, INC. (US) 2008-04-17 WO disclosed
WO-2008045834-A2 KINASE INHIBITORS TAKEDA SAN DIEGO, INC. (US) 2008-04-17 WO disclosed
US-20070117816-A1 KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-05-24 US disclosed
US-20070117816-A1 KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-05-24 US disclosed
US-20070117816-A1 KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-05-24 US disclosed
WO-2007044779-A1 KINASE INHIBITORS TAKEDA SAN DIEGO, INC. (US) 2007-04-19 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 (5 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-10597376-B2 Inhibitors of lysine specific demethylase-1 KDM1B, KDM1A, KDM3A ALDH1A1 208/4885SMN1; SMN2 3099/4885BRD4 113/4885
US-11028066-B2 Inhibitors of lysine specific demethylase-1 KDM1B, KDM1A, KDM3A ALDH1A1 208/4885SMN1; SMN2 3099/4885BRD4 113/4885
US-20070117816-A1 KINASE INHIBITORS MAP3K20, MAP3K19, MAP3K1 ALDH1A1 4208/4885SMN1; SMN2 4339/4885BRD4 804/4885
US-20200172506-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 KDM1B, KDM1A, KDM3A ALDH1A1 208/4885SMN1; SMN2 3099/4885BRD4 113/4885
US-20180273505-A1 INHIBITORS OF LYSINE SPECIFIC DEMETHYLASE-1 KDM1B, KDM1A, KDM3A ALDH1A1 208/4885SMN1; SMN2 3099/4885BRD4 113/4885

“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.