SCHEMBL27347334

SCHEMBL27347334

Cc1ccc2c(c1)[C@@H](CC(=O)O)CO2

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 17/20 0.60
PPARG P37231 5/20 0.60
PPARD Q03181 5/20 0.60

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
SCHEMBL27347336 1.00 FFAR1 (0.60) FFAR1PPARGPPARD
SCHEMBL27347333 1.00 FFAR1 (0.60) FFAR1PPARGPPARD
SCHEMBL15299338 0.89 FFAR1 (0.69) FFAR1PPARGPPARD
SCHEMBL15292428 0.89 FFAR1 (0.69) FFAR1PPARGPPARD
SCHEMBL28279575 0.84 PPARG (0.52) FFAR1PPARGPPARD
SCHEMBL6100632 0.82 HTR1A (0.43) FFAR1PPARGPPARD
SCHEMBL30295621 0.82 HTR1A (0.43) FFAR1PPARGPPARD
SCHEMBL6214519 0.81 FFAR1 (0.59) FFAR1PPARGPPARD
SCHEMBL10443920 0.81 PPARG (0.50) FFAR1PPARGPPARD
SCHEMBL7432114 0.81 HTR1A (0.56) FFAR1PPARGPPARD

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-2024026290-A1 NOVEL HETEROCYCLES AS sPLA2-X INHIBITORS CAYMAN CHEMICAL COMPANY INCORPORATED (US) 2024-02-01 WO disclosed