SCHEMBL5325083

SCHEMBL5325083

Cc1nc(Cc2ccc(Cl)cc2)sc1C(=O)NCc1ccc(F)cc1

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.56
PPARD Q03181 1/20 0.56
CHRM4 P08173 3/20 0.53
GAA P10253 1/20 0.52
MAPT P10636 3/20 0.52
SCD O00767 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
CYP2D6 P10635 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
HTT P42858 1/20 0.51
KLKB1 P03952 1/20 0.51
TP53 P04637 2/20 0.49
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
TSHR P16473 1/20 0.48
THRB P10828 1/20 0.48

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
SCHEMBL5328060 0.85 PPARA (0.58) PPARAPPARDCHRM4GAAMAPT
SCHEMBL244641 0.79 SCD (0.58) PPARACHRM4MAPTSCDSMN1; SMN2
SCHEMBL12464766 0.79 PPARA (0.69) PPARAPPARDCHRM4GAAMAPT
SCHEMBL13541868 0.79 PPARA (0.69) PPARAPPARDMAPTSCD
SCHEMBL3042709 0.78 CHRM4 (0.57) PPARACHRM4MAPTSCDSMN1; SMN2
SCHEMBL3454547 0.78 SCD (0.57) PPARACHRM4MAPTSCDSMN1; SMN2
SCHEMBL3455092 0.78 PPARD (0.56) PPARAPPARDCHRM4GAAMAPT
SCHEMBL3575995 0.78 CHRM4 (0.61) PPARAPPARDCHRM4GAAMAPT
SCHEMBL18320904 0.78 SMN1; SMN2 (0.55) PPARAGAAMAPTSMN1; SMN2KLKB1
SCHEMBL4285011 0.78 RAB9A (0.71) GAAMAPTSMN1; SMN2ALDH1A1LMNA

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-2007138110-A2 COMPOUNDS THAT INTERACT WITH ION CHANNELS, IN PARTICULAR WITH ION CHANNELS FROM THE KV FAMILY DEVGEN N.V. (BE) 2007-12-06 WO claimed