SCHEMBL4781479

SCHEMBL4781479

COc1ccc(C2CC(CNS(=O)(=O)c3ccc(Cl)cc3)=NN2c2ccc(Cl)cc2Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.51
CNR2 P34972 5/20 0.51
L3MBTL1 Q9Y468 3/20 0.48
KMT2A Q03164 2/20 0.46
ALDH1A1 P00352 1/20 0.46
MEN1 O00255 1/20 0.42
KDR P35968 2/20 0.42
EGFR P00533 1/20 0.42
FLT1 P17948 1/20 0.41
FLT4 P35916 1/20 0.41
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
TSHR P16473 1/20 0.41
LMNA P02545 1/20 0.41
CYP19A1 P11511 1/20 0.41
CCR1 P32246 1/20 0.41

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
SCHEMBL2540077 1.00 CNR1 (0.51) CNR1CNR2L3MBTL1KMT2AALDH1A1
SCHEMBL2539512 0.95 CNR1 (0.47) CNR1CNR2L3MBTL1KMT2AALDH1A1
SCHEMBL2537616 0.95 CNR1 (0.47) CNR1CNR2L3MBTL1KMT2AALDH1A1
SCHEMBL2538690 0.95 CNR1 (0.52) CNR1CNR2L3MBTL1KMT2AALDH1A1
SCHEMBL2538885 0.93 RAB9A (0.47) CNR1CNR2L3MBTL1KDREGFR
SCHEMBL2537283 0.92 CNR1 (0.55) CNR1CNR2KMT2AALDH1A1MEN1
SCHEMBL2536146 0.92 CNR1 (0.54) CNR1CNR2L3MBTL1KMT2AALDH1A1
SCHEMBL2545412 0.91 CNR1 (0.49) CNR1CNR2L3MBTL1KMT2AALDH1A1
SCHEMBL2535596 0.91 CNR1 (0.46) CNR1CNR2L3MBTL1KMT2AALDH1A1
SCHEMBL2545237 0.91 CNR1 (0.43) CNR1CNR2L3MBTL1KMT2AALDH1A1

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
WO-2008062424-A2 SUBSTITUTED 4,5-DIHYDRO-1H-PYRAZOLE DERIVATIVES AS CANNABINOID MODULATORS CADILA HEALTHCARE LIMITED (IN) 2008-05-29 WO claimed
WO-2008062424-A2 SUBSTITUTED 4,5-DIHYDRO-1H-PYRAZOLE DERIVATIVES AS CANNABINOID MODULATORS CADILA HEALTHCARE LIMITED (IN) 2008-05-29 WO disclosed