SCHEMBL14411400

SCHEMBL14411400

Bc1ccc(OC)c(S(C)(=O)=O)c1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 3/20 0.65
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ TSHR P16473 3/20 0.41
▸ POLB P06746 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ GAA P10253 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ USP2 O75604 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.38
▸ GLA P06280 1/20 0.38
▸ HTR6 P50406 1/20 0.38
▸ WDR5 P61964 1/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ RAB9A P51151 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
SCHEMBL14047981 0.83 TRPV4 (0.51) SMN1; SMN2L3MBTL1TSHRPOLBMAPK1
SCHEMBL25976983 0.80 L3MBTL1 (0.68) SMN1; SMN2L3MBTL1MAPK1GAAKMT2A
SCHEMBL5960683 0.78 SMN1; SMN2 (0.67) SMN1; SMN2L3MBTL1MAPK1GAAKMT2A
SCHEMBL12180426 0.78 SMN1; SMN2 (0.67) SMN1; SMN2L3MBTL1TSHRPOLBMAPK1
SCHEMBL30514814 0.77 SMN1; SMN2 (0.65) SMN1; SMN2TSHRGAAKMT2APKM
SCHEMBL1790129 0.77 SMN1; SMN2 (0.65) SMN1; SMN2TSHRGAAKMT2APKM
SCHEMBL2650962 0.77 SMN1; SMN2 (0.65) SMN1; SMN2L3MBTL1TSHRPOLBMAPK1
SCHEMBL16316790 0.77 SMN1; SMN2 (0.65) SMN1; SMN2L3MBTL1TSHRPOLBMAPK1
SCHEMBL4572998 0.77 SMN1; SMN2 (0.65) SMN1; SMN2L3MBTL1TSHRPOLBMAPK1
SCHEMBL10710253 0.76 SMN1; SMN2 (0.62) SMN1; SMN2L3MBTL1TSHRPOLBMAPK1

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-1500657-B1 Substituted pyrazoles as P38 kinase inhibitors SEARLE LLC (US) 2007-09-19 — — EP disclosed
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