SCHEMBL16958596

SCHEMBL16958596

CCCc1ccc(CO)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.40
IDO1 P14902 1/20 0.39
CNR2 P34972 2/20 0.37
RECQL P46063 1/20 0.37
CNR1 P21554 1/20 0.37
SIGMAR1 Q99720 2/20 0.37
S1PR1 P21453 4/20 0.36
NPC1 O15118 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TTR P02766 1/20 0.36
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
NLRP1 Q9C000 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35
VDR P11473 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
SCHEMBL12045765 0.86 ALOX5 (0.47) ALOX5CNR2CNR1SIGMAR1SMN1; SMN2
SCHEMBL15778552 0.84 LMNA (0.43) IDO1RECQLS1PR1NPC1HPGD
SCHEMBL9747637 0.82 CNR1 (0.41) ALOX5CNR2CNR1LMNAGABRA1
SCHEMBL522987 0.81 RECQL (0.43) IDO1RECQLNPC1HPGDRAB9A
SCHEMBL14922851 0.78 BACE1 (0.42) ALOX5CNR2CNR1LMNAVDR
SCHEMBL16954455 0.78 VDR (0.41) ALOX5CNR2CNR1S1PR1VDR
SCHEMBL6301168 0.78 SKP2 (0.43) SIGMAR1S1PR1NPC1HPGDRAB9A
SCHEMBL16951823 0.77 CNR2 (0.37) ALOX5CNR2CNR1LMNAVDR
SCHEMBL16952436 0.77 CYP4F2 (0.41) ALOX5CNR2CNR1S1PR1LMNA
SCHEMBL18075992 0.77 LMNA (0.41) ALOX5CNR2CNR1SIGMAR1LMNA

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-2900645-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION Bayer CropScience AG (DE) 2015-08-05 EP disclosed