SCHEMBL22072755

SCHEMBL22072755

C1=Nc2cccc(-c3cccc4scnc34)c2NC1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31

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
SCHEMBL22013891 0.68 ALDH1A1 (0.46) NAMPTALDH1A1HSD17B10
SCHEMBL27920219 0.66 ALDH1A1 (0.46) NAMPTALDH1A1HSD17B10
SCHEMBL27451256 0.66 ALDH1A1 (0.42) NAMPTALDH1A1HSD17B10
SCHEMBL27877183 0.66 ALDH1A1 (0.42) NAMPTALDH1A1HSD17B10
SCHEMBL12637458 0.66 ALDH1A1 (0.42) NAMPTALDH1A1HSD17B10
SCHEMBL926871 0.65 NAMPT (0.46) NAMPTALDH1A1HSD17B10
SCHEMBL12637452 0.65 ALDH1A1 (0.41) NAMPTALDH1A1HSD17B10
Nitrogen SCHEMBL27920230 0.64 ALDH1A1 (0.43) NAMPTALDH1A1HSD17B10
SCHEMBL12637453 0.63 NAMPT (0.47) NAMPTALDH1A1HSD17B10
SCHEMBL12637455 0.63 CYP3A4 (0.39) ALDH1A1HSD17B10

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
WO-2020113759-A1 METHOD OF TREATING AGE-RELATED MACULAR DEGENERATION ZHUHAI QIWEI BIO-TECHNOLOGY LTD. (CN) 2020-06-11 — — WO disclosed
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