SCHEMBL7354871

SCHEMBL7354871

CCCc1ccc2c(c1)=CC(=O)N=2

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
MGLL Q99685 1/20 0.35
ADAMTS5 Q9UNA0 2/20 0.34
GPR84 Q9NQS5 3/20 0.33
CA2 P00918 1/20 0.33
MMP12 P39900 1/20 0.32
PLK1 P53350 1/20 0.32
LPL P06858 1/20 0.32
LIPG Q9Y5X9 1/20 0.32
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
RAB9A P51151 2/20 0.31
ALOX5 P09917 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
GFER P55789 1/20 0.31
THRB P10828 1/20 0.31
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL10374047 0.90 ALDH1A1 (0.41) GPR84CA2PLK1RAB9ANPC1
SCHEMBL5485288 0.86 NPC1 (0.38) MGLLRAB9ANPC1MAPTALDH1A1
SCHEMBL29111860 0.83 TAAR1 (0.39) HTR2AMAPTGFERALDH1A1
SCHEMBL4551281 0.79 FFAR1 (0.43) CA2
SCHEMBL4551222 0.79 MEN1 (0.44)
SCHEMBL29111808 0.73 LMNA (0.36) CA2MAPTALDH1A1
SCHEMBL29111807 0.73 LMNA (0.36) CA2MAPTALDH1A1
SCHEMBL29111825 0.73 LMNA (0.36) CA2MAPTALDH1A1
SCHEMBL29265006 0.72 NTRK1 (0.36)
SCHEMBL29111858 0.69 TAAR1 (0.39) HTR2AMAPTGFERALDH1A1

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-0581939-B1 N-SULPHONYL-2-OXOINDOLE DERIVATIVES HAVING AFFINITY FOR VASOPRESSIN AND/OR OCYTOCIN RECEPTORS SANOFI SA (FR) 1999-06-02 EP disclosed
EP-0581939-A1 N-SULPHONYL-2-OXOINDOLE DERIVATIVES HAVING AFFINITY FOR VASOPRESSIN AND/OR OCYTOCIN RECEPTORS SANOFI (FR) 1994-02-09 EP disclosed
WO-1993015051-A1 N-SULPHONYL-2-OXOINDOLE DERIVATIVES HAVING AFFINITY FOR VASOPRESSIN AND/OR OCYTOCIN RECEPTORS ELF SANOFI (FR) 1993-08-05 WO disclosed