SCHEMBL9579657

SCHEMBL9579657

Clc1cc2c(c(Cl)c1Cl)O2

nearest known ligand 0.86

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AHR P35869 16/20 0.86
FLT1 P17948 1/20 0.48
CYP3A4 P08684 2/20 0.45
ALDH1A1 P00352 1/20 0.36
HPGD P15428 2/20 0.36
TSHR P16473 2/20 0.36
HSD17B10 Q99714 2/20 0.36
HSP90AA1 P07900 1/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL29353218 1.00 AHR (0.86) AHRFLT1CYP3A4ALDH1A1HPGD
SCHEMBL5967950 1.00 AHR (0.86) AHRFLT1CYP3A4ALDH1A1HPGD
SCHEMBL30118871 1.00 AHR (0.86) AHRFLT1CYP3A4ALDH1A1HPGD
SCHEMBL29353294 0.93 AHR (1.00) AHRFLT1CYP3A4
SCHEMBL29353335 0.93 AHR (0.75) AHRFLT1CYP3A4ALDH1A1HPGD
SCHEMBL2885718 0.93 AHR (1.00) AHRFLT1CYP3A4
SCHEMBL2879834 0.93 AHR (0.75) AHRFLT1CYP3A4ALDH1A1HPGD
SCHEMBL2464142 0.92 AHR (0.82) AHRFLT1CYP3A4ALDH1A1HPGD
SCHEMBL29353168 0.92 AHR (0.82) AHRFLT1CYP3A4ALDH1A1HPGD
SCHEMBL30118867 0.92 AHR (0.82) AHRFLT1CYP3A4ALDH1A1HPGD

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
US-5200454-A Blend of syndiotactic polymer, thermoplastic resin, halogenated polystyrenes and phosphine oxide IDEMITSU KOSAN COMPANY LIMITED (JP) 1993-04-06 US disclosed