SCHEMBL9096478

SCHEMBL9096478

CSc1ccc(C=C(C#N)S(=O)(=O)c2ccc(C(F)(F)F)cc2)s1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 3/20 0.38
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ HPGD P15428 7/20 0.38
▸ KMT2A Q03164 6/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ PPME1 Q9Y570 2/20 0.36
▸ ALDH1A1 P00352 6/20 0.35
▸ MAPT P10636 5/20 0.35
▸ MEN1 O00255 5/20 0.35
▸ LMNA P02545 4/20 0.35
▸ KDM4E B2RXH2 3/20 0.35
▸ POLB P06746 2/20 0.35
▸ HSD17B10 Q99714 2/20 0.34
▸ GAA P10253 1/20 0.34
▸ ALPG P10696 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ ALOX12 P18054 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ CASP1 P29466 1/20 0.34

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
SCHEMBL8429514 1.00 PKM (0.38) PKML3MBTL1HPGDKMT2ASMN1; SMN2
SCHEMBL8429517 1.00 PKM (0.38) PKML3MBTL1HPGDKMT2ASMN1; SMN2
SCHEMBL8425872 0.83 PPME1 (0.39) PKML3MBTL1HPGDKMT2ASMN1; SMN2
SCHEMBL9098601 0.83 PPME1 (0.39) PKML3MBTL1HPGDKMT2ASMN1; SMN2
SCHEMBL8425871 0.83 PPME1 (0.39) PKML3MBTL1HPGDKMT2ASMN1; SMN2
SCHEMBL8429738 0.79 KMT2A (0.36) PKML3MBTL1HPGDKMT2ASMN1; SMN2
SCHEMBL8429739 0.79 KMT2A (0.36) PKML3MBTL1HPGDKMT2ASMN1; SMN2
SCHEMBL8429741 0.79 KMT2A (0.36) PKML3MBTL1HPGDKMT2ASMN1; SMN2
SCHEMBL9096474 0.78 HPGD (0.40) PKML3MBTL1HPGDKMT2ASMN1; SMN2
SCHEMBL9096466 0.78 HPGD (0.40) PKML3MBTL1HPGDKMT2ASMN1; SMN2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996040675-A1 THIENYL COMPOUNDS FOR INHIBITION OF CELL PROLIFERATIVE DISORDERS SUGEN, INC. (US) 1996-12-19 — — WO claimed
WO-1996040675-A1 THIENYL COMPOUNDS FOR INHIBITION OF CELL PROLIFERATIVE DISORDERS SUGEN, INC. (US) 1996-12-19 — — WO disclosed
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