SCHEMBL20888467

SCHEMBL20888467

Cc1ccc(Cc2ccc(I)c(C)c2)cc1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.48
▸ ESR2 Q92731 1/20 0.48
▸ NQO1 P15559 2/20 0.37
▸ LMNA P02545 2/20 0.37
▸ HTT P42858 1/20 0.37
▸ CCNC P24863 1/20 0.35
▸ CDK8 P49336 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.34
▸ CA2 P00918 2/20 0.34
▸ CYP3A4 P08684 3/20 0.34
▸ CYP2C19 P33261 3/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ HIF1A Q16665 1/20 0.34
▸ GPR174 Q9BXC1 1/20 0.34
▸ S1PR1 P21453 1/20 0.34
▸ ADORA2A P29274 1/20 0.33
▸ ADORA1 P30542 1/20 0.33
▸ CHEK2 O96017 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA4 P22748 1/20 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
SCHEMBL19154351 0.93 ESR1 (0.54) ESR1ESR2ALDH1A1CA2CYP3A4
SCHEMBL311076 0.86 ESR1 (0.61) ESR1ESR2NQO1LMNAHTT
SCHEMBL30876036 0.86 ESR1 (0.61) ESR1ESR2NQO1LMNAHTT
SCHEMBL31371688 0.86 ESR1 (0.61) ESR1ESR2NQO1LMNAHTT
SCHEMBL21346932 0.79 PTGS1 (0.41) ESR1ESR2S1PR1
SCHEMBL23821926 0.77 ESR1 (0.37) ESR1ESR2NQO1LMNAHTT
SCHEMBL20055631 0.77 ESR1 (0.52) ESR1ESR2NQO1LMNAHTT
SCHEMBL8065786 0.77 TRPA1 (0.43) ESR1ESR2LMNAHTTALDH1A1
SCHEMBL20345259 0.77 ESR1 (0.52) ESR1ESR2NQO1CCNCCDK8
SCHEMBL20549337 0.76 ESR1 (0.35) ESR1ESR2CA2CYP3A4CYP2C19

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-11530357-B2 Liquid crystal alignment agent and liquid crystal panel SHARP KABUSHIKI KAISHA (JP) 2022-12-20 — — US disclosed
US-20200208056-A1 LIQUID CRYSTAL ALIGNMENT AGENT AND LIQUID CRYSTAL PANEL SHARP KABUSHIKI KAISHA (JP) 2020-07-02 — — US disclosed
US-20190106629-A1 LIQUID CRYSTAL DISPLAY DEVICE SHARP KABUSHIKI KAISHA (JP) 2019-04-11 — — US disclosed
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