SCHEMBL7568415

SCHEMBL7568415

CCCc1ccc(-c2ccc(C3CCCCC3)cc2)c(F)c1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.43
CYP2C9 P11712 1/20 0.43
APP P05067 1/20 0.43
EPHX2 P34913 1/20 0.41
FFAR4 Q5NUL3 2/20 0.41
CTSL P07711 1/20 0.37
CTSS P25774 1/20 0.37
CTSK P43235 1/20 0.37
CHKA P35790 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
HSP90AA1 P07900 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
NOTUM Q6P988 1/20 0.35
NOS3 P29474 2/20 0.35
NOS1 P29475 2/20 0.35
NOS2 P35228 2/20 0.35
S1PR1 P21453 3/20 0.34

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
SCHEMBL24778683 0.89 CYP3A4 (0.47) CYP3A4CYP2C9APPFFAR4CHKA
SCHEMBL7761135 0.88 CTSL (0.36) CYP3A4CYP2C9APPFFAR4CTSL
SCHEMBL18511927 0.88 ESR2 (0.41) CYP3A4CYP2C9APPFFAR4CTSL
SCHEMBL19445437 0.86 FFAR4 (0.37) CYP3A4CYP2C9APPFFAR4CTSL
SCHEMBL19129806 0.86 CTSL (0.36) CYP3A4CYP2C9FFAR4CTSLCTSS
SCHEMBL20111309 0.86 CYP3A4 (0.40) CYP3A4CYP2C9APPEPHX2FFAR4
SCHEMBL21609919 0.86 FFAR4 (0.42) CYP3A4CYP2C9APPFFAR4
SCHEMBL20273239 0.85 CYP2C9 (0.45) CYP3A4CYP2C9FFAR4CTSLCTSS
SCHEMBL18712355 0.85 CYP3A4 (0.46) CYP3A4CYP2C9APPFFAR4CTSL
SCHEMBL7167863 0.85 FFAR4 (0.39) CYP3A4CYP2C9APPEPHX2FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9580652-B2 Liquid crystal compound, liquid crystal composition including the same and liquid crystal display including the liquid crystal composition SAMSUNG DISPLAY CO., LTD. (KR) 2017-02-28 US disclosed
US-20170045765-A1 LCD DEVICE DIC CORPORATION (JP) 2017-02-16 US disclosed
EP-0667555-B1 Active matrix type liquid crystal display apparatus HITACHI LTD (JP) 2002-08-28 EP disclosed
EP-0667555-A1 Active matrix type liquid crystal display apparatus HITACHI, LTD. (JP) 1995-08-16 EP disclosed