SCHEMBL18238563

SCHEMBL18238563

NC(=O)C=Cc1c[nH]c2ncc(C=O)cc12

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAP3K7 O43318 12/20 0.44
▸ TAB1 Q15750 12/20 0.44
▸ KMT2A Q03164 1/20 0.39
▸ GSK3B P49841 6/20 0.38
▸ AXL P30530 1/20 0.36

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
SCHEMBL16945239 1.00 MAP3K7 (0.44) MAP3K7TAB1KMT2AGSK3BAXL
SCHEMBL18250590 0.86 MAP3K7 (0.44) MAP3K7TAB1KMT2AGSK3BAXL
SCHEMBL4348310 0.83 MAP3K7 (0.44) MAP3K7TAB1GSK3BAXL
SCHEMBL24764929 0.82 KMT2A (0.54) KMT2AGSK3BAXL
SCHEMBL24197757 0.82 MAP3K7 (0.46) MAP3K7TAB1GSK3B
SCHEMBL16945143 0.80 MAP3K7 (0.53) MAP3K7TAB1GSK3BAXL
SCHEMBL18238627 0.80 MAP3K7 (0.53) MAP3K7TAB1GSK3BAXL
SCHEMBL18238269 0.78 MAP3K7 (0.46) MAP3K7TAB1GSK3B
SCHEMBL16945189 0.78 MAP3K7 (0.46) MAP3K7TAB1GSK3B
SCHEMBL4346952 0.78 MAP3K7 (0.43) MAP3K7TAB1GSK3BAXL

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
US-9499551-B2 Substituted pyrrolo[2,3-b]pyridines for treating cancer or inflammatory diseases CONFLUENCE LIFE SCIENCES, INC. (US) 2016-11-22 — — US disclosed
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