SCHEMBL22365355

SCHEMBL22365355

COC(=O)C(C)Cc1cccc(OCC2CC(c3ccnc(OC)c3)C2)c1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 15/20 0.60
▸ SLC2A1 P11166 2/20 0.38
▸ CYP3A4 P08684 1/20 0.37
▸ KDM5A P29375 1/20 0.36
▸ KDM4C Q9H3R0 1/20 0.36

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
SCHEMBL22365329 0.91 FFAR1 (0.66) FFAR1
SCHEMBL22365291 0.88 FFAR1 (0.58) FFAR1
SCHEMBL22365350 0.86 FFAR1 (0.56) FFAR1
SCHEMBL22365303 0.84 FFAR1 (0.62) FFAR1
SCHEMBL22365412 0.82 FFAR1 (0.61) FFAR1
SCHEMBL22365447 0.82 GPR88 (0.43) FFAR1
SCHEMBL22365454 0.82 FFAR1 (0.42) FFAR1
SCHEMBL22365407 0.81 FFAR1 (0.43) FFAR1
SCHEMBL22365237 0.80 ACACA (0.50) SLC2A1KDM5AKDM4C
SCHEMBL17000290 0.80 FFAR1 (0.85) FFAR1

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
EP-3102198-B1 ANTIDIABETIC COMPOUNDS MERCK SHARP & DOHME (US) 2020-08-26 — — EP disclosed
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