SCHEMBL22868044

SCHEMBL22868044

Cc1ccc2c(c1)[C@@H](O)CC[C@H]2NC(=O)c1ccc(C(F)(F)F)[nH]c1=O

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD17B2 P37059 20/20 0.81
HSD17B1 P14061 8/20 0.77

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
SCHEMBL29580885 1.00 HSD17B2 (0.81) HSD17B2HSD17B1
SCHEMBL29581364 1.00 HSD17B2 (0.81) HSD17B2HSD17B1
SCHEMBL22867219 1.00 HSD17B2 (0.81) HSD17B2HSD17B1
SCHEMBL22867992 1.00 HSD17B2 (0.81) HSD17B2HSD17B1
SCHEMBL22867536 0.90 HSD17B2 (1.00) HSD17B2HSD17B1
SCHEMBL29581423 0.90 HSD17B2 (1.00) HSD17B2HSD17B1
SCHEMBL22867479 0.89 HSD17B2 (0.80) HSD17B2HSD17B1
SCHEMBL22867483 0.89 HSD17B2 (0.80) HSD17B2HSD17B1
SCHEMBL22867766 0.89 HSD17B2 (0.80) HSD17B2HSD17B1
SCHEMBL29581166 0.89 HSD17B2 (0.80) HSD17B2HSD17B1

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-2021003295-A1 MODULATORS OF HSD17B13 AND METHODS OF USE THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2021-01-07 WO disclosed