SCHEMBL18238366

SCHEMBL18238366

CC(C)(O)COc1ccc(-c2cnc3[nH]cc(C=CC(N)=O)c3c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAP3K7 O43318 8/20 0.54
▸ TAB1 Q15750 8/20 0.54
▸ SGK1 O00141 2/20 0.40
▸ KIT P10721 1/20 0.40
▸ AXL P30530 2/20 0.40
▸ CLK1 P49759 1/20 0.39
▸ DYRK1A Q13627 1/20 0.39
▸ DYRK2 Q92630 1/20 0.39
▸ DYRK1B Q9Y463 1/20 0.39
▸ MAP4K4 O95819 1/20 0.39
▸ AAK1 Q2M2I8 2/20 0.39
▸ CAMKK2 Q96RR4 1/20 0.39
▸ TNIK Q9UKE5 1/20 0.38

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
SCHEMBL16945169 1.00 MAP3K7 (0.54) MAP3K7TAB1SGK1KITAXL
SCHEMBL18250493 0.91 MAP3K7 (0.43) MAP3K7TAB1SGK1KITAXL
SCHEMBL18238117 0.89 MAP3K7 (0.53) MAP3K7TAB1SGK1AXLCLK1
SCHEMBL16945198 0.89 MAP3K7 (0.53) MAP3K7TAB1SGK1AXLCLK1
SCHEMBL16948727 0.88 MAP3K7 (0.60) MAP3K7TAB1
SCHEMBL18238764 0.88 MAP3K7 (0.60) MAP3K7TAB1
SCHEMBL16932982 0.86 KIT (0.55) MAP3K7TAB1SGK1KITAXL
SCHEMBL16932979 0.86 KIT (0.55) MAP3K7TAB1SGK1KITAXL
SCHEMBL16945176 0.85 SGK1 (0.48) MAP3K7TAB1SGK1AXLCLK1
SCHEMBL18239033 0.85 SGK1 (0.48) MAP3K7TAB1SGK1AXLCLK1

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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