SCHEMBL10586409

SCHEMBL10586409

CCC(O)Cc1cccc(F)c1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 2/20 0.49
TAAR1 Q96RJ0 4/20 0.46
PPARG P37231 4/20 0.46
PPARA Q07869 3/20 0.46
IDO1 P14902 2/20 0.44
AGXT P21549 2/20 0.44
RIPK1 Q13546 1/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 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
SCHEMBL15178111 1.00 SLC1A1 (0.49) SLC1A1TAAR1PPARGPPARAIDO1
SCHEMBL14402470 0.87 SLC1A1 (0.45) SLC1A1TAAR1PPARGPPARAIDO1
SCHEMBL13850004 0.87 SLC1A1 (0.45) SLC1A1TAAR1PPARGPPARAIDO1
SCHEMBL13849934 0.87 SLC1A1 (0.45) SLC1A1TAAR1PPARGPPARAIDO1
SCHEMBL15066444 0.85 SLC1A1 (0.49) SLC1A1TAAR1PPARGPPARAIDO1
SCHEMBL14402789 0.84 SLC1A1 (0.43) SLC1A1TAAR1PPARGPPARAIDO1
SCHEMBL3122648 0.84 ANPEP (0.46) SLC1A1TAAR1PPARGPPARAIDO1
SCHEMBL19346590 0.83 SLC1A1 (0.55) SLC1A1TAAR1PPARGPPARAIDO1
SCHEMBL23283605 0.82 TAAR1 (0.47) SLC1A1TAAR1PPARGPPARAIDO1
SCHEMBL4426896 0.82 SLC1A1 (0.50) SLC1A1TAAR1PPARGPPARAIDO1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0321211-A1 Antifungal carbinols E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-06-21 EP claimed
EP-0321211-A1 Antifungal carbinols E.I. DU PONT DE NEMOURS AND COMPANY (US) 1989-06-21 EP disclosed