SCHEMBL9010355

SCHEMBL9010355

FC(F)(F)Oc1ccc(-c2nccs2)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.41
GPR3 P46089 1/20 0.41
ABL1 P00519 1/20 0.39
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
CASP3 P42574 1/20 0.39
EIF4E P06730 1/20 0.38
CRHR1 P34998 1/20 0.38
NTRK1 P04629 4/20 0.37
CTSA P10619 1/20 0.37
SCN5A Q14524 1/20 0.37
SCN9A Q15858 1/20 0.37
PIM1 P11309 1/20 0.37
CSNK2B P67870 1/20 0.37
CSNK2A1 P68400 1/20 0.37
PIM2 Q9P1W9 1/20 0.37
CARM1 Q86X55 1/20 0.37
PRMT1 Q99873 1/20 0.37

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
SCHEMBL18670146 0.78 NPSR1 (0.49) EIF4ESCN5ASCN9ACARM1PRMT1
SCHEMBL468075 0.75 PDPK1 (0.52) CASP3NTRK1SCN5ASCN9A
SCHEMBL8859981 0.75 FBP1 (0.49) CARM1PRMT1
SCHEMBL28251101 0.74 CTSA (0.53) NTRK1CTSA
SCHEMBL6003163 0.72 ABL1 (0.53) GPR3ABL1SCN9APIM1CSNK2B
SCHEMBL8684449 0.72 ALDH1A1 (0.41) THRATHRBCARM1PRMT1
SCHEMBL29699536 0.71 KMO (0.49) SCN5ASCN9A
SCHEMBL6482576 0.70 CARM1 (0.47) THRATHRBCARM1PRMT1
SCHEMBL27926260 0.69 GPR3 (0.49) CHRM5GPR3THRATHRBSCN5A
SCHEMBL15194320 0.69 ALDH1A1 (0.46) THRATHRBCARM1PRMT1

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-0742010-A2 Benzoquinolin-3-ones to inhibit bone loss ELI LILLY AND COMPANY (US) 1996-11-13 EP disclosed