SCHEMBL3256238

SCHEMBL3256238

CCC(CC)CNc1[nH]nc2c1CN(NC(=O)Nc1cc(C)ccc1C)C2

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 1/20 0.38
NLRP3 Q96P20 1/20 0.38
BRD4 O60885 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
APOBEC3A P31941 1/20 0.36
CYP2C19 P33261 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
KMT2A Q03164 4/20 0.36
TP53 P04637 3/20 0.36
MEN1 O00255 3/20 0.36
RAB9A P51151 2/20 0.36
MAPT P10636 2/20 0.35
NPC1 O15118 1/20 0.35
LMNA P02545 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
SCHEMBL2924294 0.87 POLB (0.40) POLBSMN1; SMN2ALDH1A1NLRP3BRD4
SCHEMBL3256241 0.84 AURKA (0.39) POLBSMN1; SMN2ALDH1A1NLRP3CYP1A2
SCHEMBL2920137 0.78 NR1H4 (0.42) POLBAPOBEC3AAPOBEC3GKMT2ATP53
SCHEMBL3257708 0.75 MAPK1 (0.35) POLBSMN1; SMN2ALDH1A1KMT2AMEN1
SCHEMBL3243651 0.74 EPHX1 (0.37) SMN1; SMN2ALDH1A1CYP3A4CYP2C19TP53
SCHEMBL2924288 0.74 CCNA2 (0.42) POLBSMN1; SMN2ALDH1A1NLRP3CYP1A2
SCHEMBL2920141 0.65 AURKA (0.54) TP53RAB9A
SCHEMBL3134595 0.64 HPGD (0.48) POLBSMN1; SMN2ALDH1A1RAB9AMAPT
SCHEMBL4238899 0.64 CDK2 (0.42) ALDH1A1NPC1
SCHEMBL2924353 0.64 EPHX1 (0.40) SMN1; SMN2ALDH1A1KMT2AMEN1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1320531-B1 BICYCLO-PYRAZOLES ACTIVE AS KINASE INHIBITORS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM PFIZER ITALIA SRL (IT) 2010-09-08 EP claimed