SCHEMBL10019670

SCHEMBL10019670

CCOc1ccc(OC(=O)c2ccc3c(c2F)C(F)(F)C(F)(F)c2c-3ccc(OCC)c2F)cc1F

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
FFAR1 O14842 8/20 0.37
PPARD Q03181 4/20 0.37
KMT2A Q03164 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
SCN9A Q15858 1/20 0.34
HIF1A Q16665 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
KCNQ3 O43525 1/20 0.33
KCNQ2 O43526 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
SCHEMBL10019672 0.93 KDM4E (0.41) FFAR1PPARDKDM4EMAPTPTGS2
SCHEMBL10019667 0.91 ESR1 (0.36) ESR1ESR2FFAR1PPARDKMT2A
SCHEMBL10019358 0.90 KDM4E (0.39) ESR1ESR2KMT2AKDM4EMAPT
SCHEMBL19622078 0.89 ESR1 (0.37) ESR1ESR2FFAR1PPARDKMT2A
SCHEMBL10019356 0.87 ALDH1A1 (0.34) ESR1ESR2KMT2AKDM4EPTGS1
SCHEMBL10019871 0.87 KDM4E (0.41) FFAR1PPARDKDM4EMAPTTHRB
SCHEMBL10019635 0.87 ESR1 (0.33) ESR1ESR2KMT2AKDM4EMAPT
SCHEMBL10019361 0.85 MAPT (0.44) ESR1ESR2KMT2AKDM4EMAPT
SCHEMBL15257942 0.85 ALDH1A1 (0.34) ESR1ESR2KMT2AKDM4EPTGS1
SCHEMBL10019668 0.84 PDE5A (0.35) KMT2AMAPTPTGS1PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2669263-B1 COMPOUND CONTAINING DIHYDROPHENANTHRENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORP (JP) 2017-11-22 EP disclosed
US-9193908-B2 Compound having dihydrophenanthrene, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-11-24 US disclosed
US-9193908-B2 Compound having dihydrophenanthrene, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2015-11-24 US disclosed
US-20130240784-A1 COMPOUND HAVING DIHYDROPHENANTHRENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2013-09-19 US disclosed
US-20130240784-A1 COMPOUND HAVING DIHYDROPHENANTHRENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC PETROCHEMICAL CORPORATION (JP) 2013-09-19 US disclosed
WO-2012086437-A1 COMPOUND CONTAINING DIHYDROPHENANTHRENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY JNC株式会社 (JP) 2012-06-28 WO disclosed