SCHEMBL2193642

SCHEMBL2193642

O=C(O)c1ccc(C(=O)O)c(CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c1CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.34
CA2 P00918 3/20 0.34
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CYP1A2 P05177 1/20 0.33
CA1 P00915 2/20 0.30

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
SCHEMBL2192230 0.87 FOLH1 (0.31)
SCHEMBL2192619 0.84
SCHEMBL2195086 0.81 CYP1A2 (0.37) THRBCA2KDM4EALDH1A1HPGD
Bromide SCHEMBL6898421 0.79
SCHEMBL2192148 0.72 KDM4E (0.30) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL24065907 0.70 ALDH1A1 (0.48) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL24065909 0.70 ALDH1A1 (0.48) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL30957035 0.70 CYP1A2 (0.35) CA2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL24065908 0.70 ALDH1A1 (0.48) KDM4EALDH1A1HPGDHSD17B10
SCHEMBL9849222 0.69 CES1 (0.41) ALDH1A1HPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8952083-B2 Fluorocopolymer composition and its production process ASAHI GLASS COMPANY, LIMITED (JP) 2015-02-10 US claimed
US-8952083-B2 Fluorocopolymer composition and its production process ASAHI GLASS COMPANY, LIMITED (JP) 2015-02-10 US disclosed
US-20110172336-A1 FLUOROCOPOLYMER COMPOSITION AND ITS PRODUCTION PROCESS ASAHI GLASS COMPANY, LIMITED (JP) 2011-07-14 US disclosed