SCHEMBL8892441

SCHEMBL8892441

Cc1ccc(Cc2c(C(=O)c3cnoc3C3CC3)ccc(F)c2C)cc1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.34
HSD17B10 Q99714 2/20 0.34
PDE2A O00408 1/20 0.34
CRACR2A Q9BSW2 2/20 0.33
RUVBL1 Q9Y265 3/20 0.33
RUVBL2 Q9Y230 1/20 0.33
CCR2 P41597 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
ALDH1A1 P00352 2/20 0.31
TSHR P16473 2/20 0.31
CHRM1 P11229 1/20 0.31
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
NAMPT P43490 1/20 0.31
NR1H4 Q96RI1 2/20 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
SCHEMBL8901541 0.94 DHODH (0.34) DHODHPDE2ACRACR2ARUVBL1SMN1; SMN2
SCHEMBL8892787 0.93 HPGD (0.36) DHODHPDE2ACRACR2ASMN1; SMN2ALDH1A1
SCHEMBL8891005 0.92 PLA2G2A (0.36) DHODHPDE2ACRACR2ASMN1; SMN2NR1H4
SCHEMBL8891580 0.82 PTGS1 (0.35) DHODHPDE2ARUVBL1LMNA
SCHEMBL8890688 0.82 LMNA (0.34) DHODHPDE2ACRACR2ARUVBL1SMN1; SMN2
SCHEMBL8890084 0.80 RUVBL1 (0.32) DHODHPDE2ARUVBL1LMNANAMPT
SCHEMBL8893301 0.80 TBXA2R (0.37) PDE2AALDH1A1
SCHEMBL8892550 0.80 ALDH1A1 (0.34) DHODHPDE2ASMN1; SMN2NPC1RAB9A
SCHEMBL8891643 0.79 CCR5 (0.35) DHODHPDE2A
SCHEMBL8891456 0.78 ALDH1A1 (0.35) PDE2AALDH1A1NAMPT

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
WO-1997028136-A1 BENZOYLISOXAZOLES AND 2-CYANO-1,3-DIONE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1997-08-07 WO disclosed