SCHEMBL7703149

SCHEMBL7703149

O=[C]c1c(F)ccc(F)c1[C]=O

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.31
CES1 P23141 2/20 0.31

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
SCHEMBL8994176 0.85 CES2 (0.37) CES2CES1
SCHEMBL95707 0.81 CES2 (0.42) CES2CES1
SCHEMBL9712454 0.77 SLC2A1 (0.35)
SCHEMBL1197431 0.77 ACHE (0.32)
SCHEMBL5202131 0.74 P2RX7 (0.31)
SCHEMBL3251732 0.74 ALDH1A1 (0.44) CES1
SCHEMBL7706646 0.73 CES2 (0.33) CES2CES1
SCHEMBL7705802 0.73 CES2 (0.36) CES2CES1
SCHEMBL6151711 0.72 CYP3A4 (0.35) CES2CES1
SCHEMBL21201458 0.72 TNF (0.32)

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
US-6355615-B1 CYCLIC POLYAMIDEESTER COPOLYMERS BAYER AKTIENGESELLSCHAFT (DE) 2002-03-12 US claimed
US-6355615-B1 CYCLIC POLYAMIDEESTER COPOLYMERS BAYER AKTIENGESELLSCHAFT (DE) 2002-03-12 US disclosed