SCHEMBL8973672

SCHEMBL8973672

CCN(CC)c1ccc(NC2(NC(C)=O)C(=O)N(c3ccc(C)cc3)N=C2c2ccccc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
RAB9A P51151 2/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 1/20 0.40
NOX1 Q9Y5S8 1/20 0.40
GHSR Q92847 2/20 0.40
MAPT P10636 4/20 0.38
LMNA P02545 3/20 0.38
TSHR P16473 3/20 0.38
HTT P42858 2/20 0.38
MAPK1 P28482 1/20 0.38
GAA P10253 1/20 0.37
CNR2 P34972 2/20 0.36
ALDH1A1 P00352 4/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TP53 P04637 1/20 0.35
POLB P06746 1/20 0.35
HCRTR1 O43613 1/20 0.35
RIPK1 Q13546 1/20 0.35

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
SCHEMBL7759267 0.96 MEN1 (0.40) MEN1RAB9AKMT2ANPC1NOX1
SCHEMBL7762454 0.95 NOX1 (0.43) MEN1RAB9AKMT2ANPC1NOX1
SCHEMBL7756057 0.91 ALDH1A1 (0.38) MEN1RAB9AKMT2ANPC1NOX1
SCHEMBL7759279 0.90 GHSR (0.40) MEN1RAB9AKMT2ANPC1NOX1
SCHEMBL8973623 0.89 MAPT (0.40) MEN1RAB9AKMT2ANPC1NOX1
SCHEMBL7759252 0.89 NOX1 (0.39) MEN1RAB9AKMT2ANPC1NOX1
SCHEMBL7759236 0.88 NPC1 (0.38) MEN1RAB9AKMT2ANPC1NOX1
SCHEMBL7759220 0.87 NPC1 (0.41) MEN1RAB9AKMT2ANPC1NOX1
Diethylamine SCHEMBL7762446 0.87 KMT2A (0.34) MEN1RAB9AKMT2ANPC1MAPT
SCHEMBL7756064 0.87 NOX1 (0.38) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
EP-0665462-A1 Thermofixable photosensitive recording material and process for preparing thereof NEW OJI PAPER CO., LTD. (JP) 1995-08-02 EP disclosed