SCHEMBL10021071

SCHEMBL10021071

C=CCCC1CCC(C(F)C(F)COc2ccc(OCC)c(F)c2)CC1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.34
FFAR1 O14842 4/20 0.32
PPARD Q03181 4/20 0.32
TUBB1 Q9H4B7 1/20 0.31
ACACB O00763 1/20 0.30

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
SCHEMBL10021304 0.86 KDM1A (0.38) KDM1AFFAR1PPARDTUBB1ACACB
SCHEMBL10021495 0.85 KDM1A (0.35) KDM1AFFAR1PPARDTUBB1ACACB
SCHEMBL10021414 0.84 KDM1A (0.34) KDM1AFFAR1PPARDACACB
SCHEMBL10021082 0.82 KDM1A (0.36) KDM1AFFAR1PPARDACACB
SCHEMBL10021064 0.77 KDM1A (0.32) KDM1A
SCHEMBL14960952 0.76 PTGES (0.31) FFAR1PPARDACACB
SCHEMBL13417736 0.75 RIPK1 (0.38) KDM1A
SCHEMBL10021190 0.74 FFAR1 (0.37) KDM1AFFAR1TUBB1
SCHEMBL10021506 0.74
SCHEMBL10021474 0.74 FFAR1 (0.33) KDM1AFFAR1PPARDACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8846164-B2 Compound having propyl ether as bonding group, liquid crystal composition thereof and liquid crystal display device thereof JNC CORPORATION (JP) 2014-09-30 US disclosed
US-8846164-B2 Compound having propyl ether as bonding group, liquid crystal composition thereof and liquid crystal display device thereof JNC CORPORATION (JP) 2014-09-30 US disclosed
US-20130126783-A1 COMPOUND HAVING PROPYL ETHER AS BONDING GROUP, LIQUID CRYSTAL COMPOSITION THEREOF AND LIQUID CRYSTAL DISPLAY DEVICE THEREOF JNC PETROCHEMICAL CORPORATION (JP) 2013-05-23 US disclosed
US-20130126783-A1 COMPOUND HAVING PROPYL ETHER AS BONDING GROUP, LIQUID CRYSTAL COMPOSITION THEREOF AND LIQUID CRYSTAL DISPLAY DEVICE THEREOF JNC PETROCHEMICAL CORPORATION (JP) 2013-05-23 US disclosed
WO-2012020643-A1 COMPOUND HAVING PROPYL ETHER AS BONDING GROUP, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC株式会社 (JP) 2012-02-16 WO disclosed