SCHEMBL8151629

SCHEMBL8151629

Cn1nc(C(O)=C(C#N)S(=O)(=O)c2ccccc2)c2ccc3cccc(Cl)c3c21

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ GAA P10253 1/20 0.31
▸ PKM P14618 1/20 0.30

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
SCHEMBL8151627 1.00 KMT2A (0.35) KMT2ASMN1; SMN2GAAPKM
SCHEMBL8150910 0.86 KMT2A (0.38) KMT2ASMN1; SMN2GAAPKM
SCHEMBL8150907 0.86 KMT2A (0.38) KMT2ASMN1; SMN2GAAPKM
SCHEMBL8151051 0.83 MAPT (0.36) KMT2ASMN1; SMN2PKM
SCHEMBL8151054 0.83 MAPT (0.36) KMT2ASMN1; SMN2PKM
SCHEMBL8151811 0.79 PKM (0.36) KMT2ASMN1; SMN2PKM
SCHEMBL8151809 0.79 PKM (0.36) KMT2ASMN1; SMN2PKM
SCHEMBL8155928 0.79 KDM4E (0.33) KMT2AGAA
SCHEMBL8154433 0.78 POLB (0.36) KMT2ASMN1; SMN2PKM
SCHEMBL8154437 0.78 POLB (0.36) KMT2ASMN1; SMN2PKM

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
EP-1019380-A2 TRICYCLIC 3-OXO-PROPANENITRILE COMPOUNDS PHARMACIA & UPJOHN S.p.A. (IT) 2000-07-19 — — EP disclosed
WO-1999016753-A2 TRICYCLIC 3-OXO-PROPANENITRILE COMPOUNDS PHARMACIA & UPJOHN S.P.A. (IT) 1999-04-08 — — WO disclosed
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