SCHEMBL6267436

SCHEMBL6267436

Cc1c(F)c(=O)oc2c[c]cc(F)c12

nearest known ligand 0.41

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ HSD17B3 P37058 1/20 0.41

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
SCHEMBL20957619 0.71 HSD17B3 (0.58) HSD17B3
SCHEMBL21379597 0.68 HSD17B3 (0.46) HSD17B3
SCHEMBL2454830 0.68 ALDH1A1 (0.50) HSD17B3
SCHEMBL3063473 0.66 HSD17B3 (0.44) HSD17B3
SCHEMBL1147722 0.66 HSD17B3 (0.51) HSD17B3
SCHEMBL10790857 0.66 HSD17B3 (0.51) HSD17B3
SCHEMBL451687 0.64 STS (0.40) HSD17B3
SCHEMBL25190307 0.63 HSD17B3 (0.42) HSD17B3
SCHEMBL4058366 0.62 RXFP1 (0.47) HSD17B3
SCHEMBL456064 0.62 — —

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-2005097818-A2 AN ASSAY SYSTEM FOR SCREENING PROTEASE INHIBITORS KECK GRADUATE INSTITUTE (US) 2005-10-20 — — WO disclosed
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