SCHEMBL10020072

SCHEMBL10020072

CCCC1CCC(CCc2ccc3c(c2F)C(F)(F)C(F)(F)c2c-3ccc(C3CCC(CCC)CC3)c2F)CC1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.33
OPRL1 P41146 12/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
MEN1 O00255 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL10019522 0.91 CTSL (0.32) CYP2C9OPRL1
SCHEMBL10019910 0.87 GAA (0.33) OPRL1MAPTMEN1KMT2A
SCHEMBL19622158 0.86 MAOA (0.33) OPRL1
SCHEMBL10019887 0.84
SCHEMBL10019545 0.83 CTSL (0.30)
SCHEMBL10019845 0.82 BCHE (0.30) MAPT
SCHEMBL12739653 0.82 CYP2C9 (0.39) CYP2C9OPRL1ALDH1A1LMNAMAPT
SCHEMBL12734826 0.82 CYP2C9 (0.39) CYP2C9OPRL1ALDH1A1LMNAMAPT
SCHEMBL12739655 0.81 CYP2C9 (0.35) CYP2C9OPRL1ALDH1A1LMNAMAPT
SCHEMBL12734828 0.81 CYP2C9 (0.35) CYP2C9OPRL1ALDH1A1LMNAMAPT

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