SCHEMBL7760958

SCHEMBL7760958

CCN(CC)c1ccc(NC2(NC(C)=O)C(=O)N(c3ccccc3)N=C2Nc2ccc(C)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.40
RAB9A P51151 3/20 0.40
KMT2A Q03164 3/20 0.40
NPC1 O15118 2/20 0.40
NOX1 Q9Y5S8 1/20 0.40
MAPT P10636 3/20 0.38
MAPK1 P28482 2/20 0.38
HTT P42858 2/20 0.38
TSHR P16473 2/20 0.38
RIPK1 Q13546 1/20 0.37
KDM1A O60341 1/20 0.37
CNR2 P34972 2/20 0.36
ALDH1A1 P00352 4/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
KDM4E B2RXH2 1/20 0.36
THRB P10828 1/20 0.36
HPGD P15428 1/20 0.36
MCL1 Q07820 1/20 0.36
ATM Q13315 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL7761051 0.96 MEN1 (0.44) MEN1RAB9AKMT2ANPC1NOX1
SCHEMBL7759244 0.91 MAPT (0.39) MEN1RAB9AKMT2ANPC1NOX1
SCHEMBL9400382 0.89 MEN1 (0.45) MEN1RAB9AKMT2ANPC1NOX1
SCHEMBL7759853 0.89 MEN1 (0.41) MEN1RAB9AKMT2ANPC1NOX1
Diethylamine SCHEMBL7760962 0.88 RIPK1 (0.36) MEN1RAB9AKMT2ANPC1MAPT
SCHEMBL7761084 0.88 NOX1 (0.45) MEN1RAB9AKMT2ANPC1NOX1
SCHEMBL7760980 0.88 LCK (0.41) MEN1RAB9AKMT2ANPC1NOX1
SCHEMBL9400423 0.87 MAPT (0.42) MEN1RAB9AKMT2ANPC1NOX1
SCHEMBL7759267 0.86 MEN1 (0.40) MEN1RAB9AKMT2ANPC1NOX1
SCHEMBL7761024 0.86 MAPT (0.43) MEN1RAB9AKMT2ANPC1NOX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0665462-B1 Thermofixable photosensitive recording material and process for preparing thereof NEW OJI PAPER CO LTD (JP) 2001-04-18 EP disclosed
US-5565306-A SUBSTRATE HAVING RECORDING LAYER CONTAINING PYRAZOLONE DERIVATIVE, HYDROQUINONE DERIVATIVE, ACIDIC SUBSTANCE MUTUALLY DISSOLVED THEREIN NEW OJI PAPER CO., LTD. (JP) 1996-10-15 US disclosed
US-5372917-A Excellent color forming property, storage stability and recorded image preservability; pyrazolone derivatives KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1994-12-13 US disclosed