SCHEMBL1799165

SCHEMBL1799165

O=C(c1nc(-c2c[nH]c3ncc(-c4ccccc4)cc23)cs1)N1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ AXL P30530 8/20 0.49
▸ SGK1 O00141 5/20 0.49
▸ CAMKK2 Q96RR4 3/20 0.49
▸ CDK8 P49336 3/20 0.49
▸ TNIK Q9UKE5 3/20 0.49
▸ MAP3K11 Q16584 2/20 0.47
▸ IGF1R P08069 1/20 0.46
▸ RIPK1 Q13546 1/20 0.46
▸ AURKA O14965 1/20 0.46
▸ CAMKK1 Q8N5S9 1/20 0.46
▸ SGK3 Q96BR1 1/20 0.46
▸ SGK2 Q9HBY8 1/20 0.46

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
SCHEMBL15500885 0.92 MAP3K11 (0.57) AXLSGK1CAMKK2CDK8TNIK
SCHEMBL1801878 0.91 HTR2C (0.56) AXLSGK1CAMKK2CDK8TNIK
SCHEMBL1800577 0.91 MAP3K11 (0.55) AXLSGK1CAMKK2CDK8TNIK
SCHEMBL4409012 0.86 MAP4K1 (0.53) TNIKMAP3K11
SCHEMBL15500866 0.86 AXL (0.45) AXLSGK1CAMKK2CDK8TNIK
SCHEMBL1796715 0.85 AXL (0.61) AXLSGK1CAMKK2CDK8TNIK
SCHEMBL1799492 0.84 TNIK (0.40) TNIKMAP3K11
SCHEMBL1798655 0.84 CYP3A4 (0.44) TNIKMAP3K11IGF1RAURKASGK2
SCHEMBL1799494 0.84 TNIK (0.39) TNIKMAP3K11
SCHEMBL4403894 0.81 MAP4K1 (0.55) TNIKMAP3K11

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-7951802-B2 Use of 7-azaindoles in the inhibition of c-Jun N-terminal kinase EISAI R&D MANAGEMENT CO., LTD. (JP) 2011-05-31 — — US disclosed
Send feedback