SCHEMBL8762864

SCHEMBL8762864

CSc1cc(Cl)ccc1C(=O)c1c(C(=O)O)noc1C1CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMURF2 Q9HAU4 1/20 0.38
SMURF1 Q9HCE7 1/20 0.38
GPBAR1 Q8TDU6 1/20 0.37
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
CASP3 P42574 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
PPARG P37231 1/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.34
NR1H4 Q96RI1 5/20 0.34
STAT3 P40763 1/20 0.33
NPC1 O15118 1/20 0.33
FABP4 P15090 1/20 0.32

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
SCHEMBL8492440 0.89 NR1H4 (0.38) GPBAR1RAB9ASMN1; SMN2ALDH1A1HPGD
SCHEMBL27500065 0.86 ALDH1A1 (0.35) SMURF2SMURF1GPBAR1RAB9ASMN1; SMN2
SCHEMBL8761934 0.84 PTGDR2 (0.37) RAB9ASMN1; SMN2ALDH1A1HPGDCASP3
SCHEMBL8492682 0.83 SMURF2 (0.40) SMURF2SMURF1GPBAR1RAB9ASMN1; SMN2
SCHEMBL8762913 0.82 SMURF2 (0.38) SMURF2SMURF1GPBAR1RAB9APPARG
SCHEMBL8763732 0.81 SMURF2 (0.37) SMURF2SMURF1GPBAR1RAB9ASMN1; SMN2
SCHEMBL7060912 0.80 SMURF2 (0.38) SMURF2SMURF1GPBAR1RAB9ASMN1; SMN2
SCHEMBL8762915 0.80 NR1H4 (0.44) SMURF2SMURF1GPBAR1PPARGPPARD
SCHEMBL8763702 0.80 SMN1; SMN2 (0.42) RAB9ASMN1; SMN2ALDH1A1HPGDNPC1
SCHEMBL27526689 0.79 PTGDR2 (0.37) SMURF2SMURF1GPBAR1SMN1; SMN2PPARG

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-0487357-B1 4 Benzoyl isoxazole derivatives RHONE POULENC AGRICULTURE (GB) 1997-07-02 EP claimed