SCHEMBL5514489

SCHEMBL5514489

CNc1cc(O)cc(F)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.55
CA1 P00915 1/20 0.55
CA9 Q16790 1/20 0.55
HCAR1 Q9BXC0 1/20 0.40
RET P07949 1/20 0.39
KIF5B P33176 1/20 0.39
KDR P35968 1/20 0.39
LMNA P02545 1/20 0.37
ALDH1A1 P00352 2/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
THRB P10828 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
CASP1 P29466 1/20 0.35
RECQL P46063 1/20 0.35
HIF1A Q16665 1/20 0.35
HSD17B10 Q99714 1/20 0.35
APP P05067 4/20 0.34
HSD17B1 P14061 2/20 0.33

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
SCHEMBL128139 0.82 LMNA (0.50) CA12CA1CA9LMNAALDH1A1
SCHEMBL5506973 0.82 RAPGEF4 (0.39) CA12CA1CA9APPRAPGEF4
SCHEMBL463544 0.82 RAPGEF4 (0.44) CA12CA1CA9APPRAPGEF4
SCHEMBL10345191 0.74 CA12 (0.46) CA12CA1CA9HCAR1RET
SCHEMBL16181574 0.73 RAPGEF4 (0.48) CYP3A4THRBRAPGEF4
SCHEMBL3226291 0.73 ALDH1A1 (0.57) HCAR1RETKIF5BKDRLMNA
SCHEMBL5510296 0.73 CA12 (0.50) CA12CA1CA9HCAR1RET
SCHEMBL25005829 0.73 MEN1 (0.35) RAPGEF4
SCHEMBL7944387 0.73 KIF11 (0.45) KDRRAPGEF4
SCHEMBL156265 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100478364-C Ethylene polymer and molded article obtained therefrom MITSUI CHEMICALS INC (JP) 2009-04-15 CN disclosed
US-7208559-B2 Ethylened polymer and molded object obtained therefrom MITSUI CHEMICALS, INC. (JP) 2007-04-24 US disclosed
US-20060135712-A1 Ethylened polymer and molded object obtained therefrom MITSUI CHEMICALS, INC. (JP) 2006-06-22 US disclosed
CN-1732189-A Ethylene polymer and molded article obtained therefrom MITSUI CHEMICALS INC (JP) 2006-02-08 CN disclosed