SCHEMBL8742182

SCHEMBL8742182

O=C(NC1C2CC3CC(C2)CC1C3)c1cc(-c2ccc(Cl)cc2)n(-c2ccc(Cl)cc2Cl)n1

nearest known ligand 0.62

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.62
RPA1 P27694 1/20 0.61
MARS1 P56192 6/20 0.55
MEN1 O00255 1/20 0.55
LMNA P02545 1/20 0.55
MAPT P10636 1/20 0.55
HTT P42858 1/20 0.55
KMT2A Q03164 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
SMPD1 P17405 2/20 0.48
CNR2 P34972 2/20 0.48
MALT1 Q9UDY8 2/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
OPRL1 P41146 1/20 0.46

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
SCHEMBL25210484 0.86 CNR1 (0.59) CNR1RPA1MARS1MEN1LMNA
SCHEMBL30513027 0.86 CNR1 (0.59) CNR1RPA1MARS1MEN1LMNA
SCHEMBL24209030 0.86 CNR1 (0.59) CNR1RPA1MARS1MEN1LMNA
SCHEMBL17203783 0.85 CNR1 (0.67) CNR1RPA1MARS1MEN1LMNA
SCHEMBL8742256 0.81 CNR1 (0.62) CNR1RPA1MARS1MEN1LMNA
SCHEMBL8742262 0.81 CNR1 (0.62) CNR1RPA1MARS1MEN1LMNA
SCHEMBL8042547 0.81 CNR2 (0.50) MARS1LMNAHTTSMN1; SMN2SMPD1
SCHEMBL8742218 0.80 CNR2 (0.70) CNR1CNR2
SCHEMBL30513092 0.80 CNR2 (0.70) CNR1CNR2
SCHEMBL8197517 0.79 RPA1 (0.80) CNR1RPA1MARS1MEN1LMNA

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
US-5624941-A Pyrazole derivatives, method of preparing them and pharmaceutical compositions in which they are present SANOFI (FR) 1997-04-29 US disclosed
EP-0576357-B1 Pyrazole derivatives, process for their preparation and pharmaceutical compositions containing them SANOFI SA (FR) 1997-03-05 EP disclosed
EP-0576357-A1 Pyrazole derivatives, process for their preparation and pharmaceutical compositions containing them SANOFI (FR) 1993-12-29 EP disclosed