SCHEMBL10019667

SCHEMBL10019667

CCCc1ccc(OC(=O)c2ccc3c(c2F)C(F)(F)C(F)(F)c2c-3ccc(OCC)c2F)cc1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
KMT2A Q03164 1/20 0.34
MAPT P10636 2/20 0.34
THRB P10828 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.33
CASP3 P42574 1/20 0.33
RAB9A P51151 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
SSTR5 P35346 2/20 0.32
FFAR1 O14842 3/20 0.31
PPARD Q03181 3/20 0.31

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
SCHEMBL10019670 0.91 ESR1 (0.39) ESR1ESR2KMT2AMAPTTHRB
SCHEMBL19622078 0.90 ESR1 (0.37) ESR1ESR2KMT2AMAPTTHRB
SCHEMBL10019635 0.90 ESR1 (0.33) ESR1ESR2KMT2AMAPTTHRB
SCHEMBL10019354 0.88 CTSL (0.37) SSTR5GABRA1GABRB2CTSLCTSS
SCHEMBL10019361 0.87 MAPT (0.44) ESR1ESR2KMT2AMAPTTHRB
SCHEMBL10020067 0.86 CTSL (0.37) GABRA1GABRB2CTSLCTSSCTSK
SCHEMBL10019672 0.86 KDM4E (0.41) MAPTSMN1; SMN2KDM4ELMNAPTGS2
SCHEMBL10019358 0.85 KDM4E (0.39) ESR1ESR2KMT2AMAPTTHRB
SCHEMBL15257953 0.85 PRSS1 (0.39) KMT2AMAPTSMN1; SMN2NPC1CASP3
SCHEMBL10019668 0.84 PDE5A (0.35) KMT2AMAPTSMN1; SMN2NPC1CASP3

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