SCHEMBL8395246

SCHEMBL8395246

COc1ccc2nccnc2c1N

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
MAPT P10636 2/20 0.54
KDM4E B2RXH2 1/20 0.54
NPC1 O15118 1/20 0.54
GAA P10253 1/20 0.54
THRB P10828 1/20 0.54
MAPK1 P28482 1/20 0.54
RAB9A P51151 1/20 0.54
BLM P54132 1/20 0.54
ATM Q13315 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
CCNB2 O95067 3/20 0.42
CDK1 P06493 3/20 0.42
CCNB1 P14635 3/20 0.42
GSK3A P49840 3/20 0.42
GSK3B P49841 3/20 0.42
CDK5 Q00535 3/20 0.42
CDK5R1 Q15078 3/20 0.42
CCNB3 Q8WWL7 3/20 0.42

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
SCHEMBL18754399 0.78 MEN1 (0.64) MEN1KMT2AMAPTKDM4ENPC1
SCHEMBL622347 0.78 KMT2A (0.59) MEN1KMT2AMAPTKDM4ENPC1
SCHEMBL16506422 0.77 MEN1 (0.57) MEN1KMT2AMAPTKDM4ENPC1
SCHEMBL8856068 0.76 LMNA (0.59) MEN1KMT2AMAPTKDM4ENPC1
SCHEMBL8396592 0.74 MAPT (0.59) MEN1KMT2AMAPTKDM4ENPC1
SCHEMBL10780561 0.74 MEN1 (0.52) MEN1KMT2AMAPTKDM4ENPC1
SCHEMBL18082985 0.74 LMNA (0.57) MEN1KMT2AMAPTKDM4EBLM
SCHEMBL87693 0.73 MAPT (0.50) MEN1KMT2AMAPTKDM4ENPC1
SCHEMBL29463681 0.73 MAPT (0.50) MEN1KMT2AMAPTKDM4ENPC1
SCHEMBL30335572 0.73 MAPT (0.50) MEN1KMT2AMAPTKDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5880135-A ANTAGONIST ACTIVITY WITH RESPECT TO CORTICOTROPIN RELEASING HORMONE SANOFI (FR) 1999-03-09 US disclosed
EP-0833822-A1 4-PHENYLAMINOTHIAZOLE DERIVATIVES, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID DERIVATIVES SANOFI (FR) 1998-04-08 EP disclosed
WO-1997000868-A1 4-PHENYLAMINOTHIAZOLE DERIVATIVES, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID DERIVATIVES SANOFI (FR) 1997-01-09 WO disclosed
US-4218369-A FOR DYEING POLYACRYLONITRILE PRODUITS CHIMIQUES UGINE KUHLMANN (FR) 1980-08-19 US disclosed