SCHEMBL11261568

SCHEMBL11261568

CCNC(=O)NC(=O)Nc1ccccc1Cl

nearest known ligand 0.61

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.61
TAS1R3 Q7RTX0 1/20 0.56
TAS1R1 Q7RTX1 1/20 0.56
RAB9A P51151 2/20 0.54
NPC1 O15118 1/20 0.54
KCNQ2 O43526 1/20 0.52
GAA P10253 1/20 0.51
CASR P41180 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
KMT2A Q03164 2/20 0.50
HTT P42858 2/20 0.50
KDM4E B2RXH2 1/20 0.50
MEN1 O00255 1/20 0.50
TP53 P04637 1/20 0.50
HPGD P15428 1/20 0.50
TSHR P16473 1/20 0.50
MAPK1 P28482 1/20 0.50
MAPKAPK2 P49137 1/20 0.50
ANPEP P15144 1/20 0.49

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
SCHEMBL13480553 0.92 TAS1R3 (0.60) CYP1A2TAS1R3TAS1R1RAB9ANPC1
SCHEMBL11139025 0.86 CYP1A2 (0.56) CYP1A2TAS1R3TAS1R1RAB9ANPC1
SCHEMBL13754118 0.80 KDM4E (0.61) CYP1A2TAS1R3TAS1R1RAB9ANPC1
SCHEMBL10458447 0.78 KDM4E (0.72) CYP1A2RAB9ANPC1GAASMN1; SMN2
SCHEMBL23069069 0.78 MEN1 (0.76) CYP1A2RAB9ANPC1GAASMN1; SMN2
SCHEMBL13296460 0.76 POLB (0.70) TAS1R3TAS1R1RAB9ANPC1CASR
SCHEMBL10400585 0.76 EPHX1 (0.57) RAB9ANPC1SMN1; SMN2KMT2AHTT
SCHEMBL8830517 0.75 SMN1; SMN2 (0.73) CYP1A2TAS1R3TAS1R1RAB9ANPC1
SCHEMBL14690405 0.75 KMT2A (0.58) CYP1A2TAS1R3TAS1R1RAB9ANPC1
SCHEMBL27714794 0.75 MAPK1 (0.61) CYP1A2TAS1R3TAS1R1RAB9ANPC1

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-4350700-A ANALGESIC, ANTIINFLAMMATORY, ANTIPYRETIC TAIHO PHARMACEUTICAL COMPANY, LIMITED (JP) 1982-09-21 US disclosed
US-4287207-A USED AS AN ANALGESIC, ANTIPYRETIC OR ANTIINFLAMMATORY AGENT TAIHO PHARMACEUTICAL COMPANY, LIMITED (JP) 1981-09-01 US disclosed