SCHEMBL18238580

SCHEMBL18238580

NC(=O)C=Cc1c[nH]c2ncc(-c3ccc(C(=O)c4ccc(Cl)cc4)cc3)cc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAP3K11 Q16584 3/20 0.44
▸ KIT P10721 2/20 0.44
▸ AXL P30530 3/20 0.44
▸ SGK1 O00141 3/20 0.44
▸ CAMKK2 Q96RR4 2/20 0.44
▸ PAK1 Q13153 1/20 0.44
▸ CDK2 P24941 2/20 0.43
▸ CCNT1 O60563 1/20 0.43
▸ CCNA2 P20248 1/20 0.43
▸ CDK9 P50750 1/20 0.43
▸ DYRK1A Q13627 2/20 0.42
▸ CLK1 P49759 1/20 0.42
▸ DYRK2 Q92630 1/20 0.42
▸ DYRK1B Q9Y463 1/20 0.42
▸ MAP4K4 O95819 2/20 0.41
▸ AAK1 Q2M2I8 1/20 0.41
▸ BRAF P15056 2/20 0.41
▸ ITK Q08881 2/20 0.40
▸ CDC7 O00311 1/20 0.40
▸ PLK4 O00444 1/20 0.40

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
SCHEMBL16949119 1.00 MAP3K11 (0.44) MAP3K11KITAXLSGK1CAMKK2
SCHEMBL18238746 0.92 MAP3K11 (0.44) MAP3K11KITAXLSGK1CAMKK2
SCHEMBL16948749 0.92 MAP3K11 (0.44) MAP3K11KITAXLSGK1CAMKK2
SCHEMBL16948899 0.91 MAP3K11 (0.41) MAP3K11KITAXLSGK1CAMKK2
SCHEMBL18238184 0.91 MAP3K11 (0.41) MAP3K11KITAXLSGK1CAMKK2
SCHEMBL18238242 0.90 AXL (0.53) MAP3K11AXLSGK1CAMKK2CDK2
SCHEMBL16949043 0.90 AXL (0.53) MAP3K11AXLSGK1CAMKK2CDK2
SCHEMBL18250466 0.89 AAK1 (0.47) MAP3K11KITAXLSGK1CAMKK2
SCHEMBL18238835 0.89 AXL (0.45) MAP3K11AXLSGK1CAMKK2CDK2
SCHEMBL16949395 0.89 AXL (0.45) MAP3K11AXLSGK1CAMKK2CDK2

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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