SCHEMBL10021082

SCHEMBL10021082

CCOc1ccc(OCC(F)C(F)C2CCC(CC)CC2)c(F)c1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.36
FFAR1 O14842 11/20 0.35
PPARD Q03181 8/20 0.35
PDE4B Q07343 1/20 0.33
ACACB O00763 2/20 0.33
ALDH1A1 P00352 1/20 0.32
NPY2R P49146 1/20 0.32
FFAR4 Q5NUL3 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
SCHEMBL10021297 0.83 KDM1A (0.40) KDM1AFFAR1PPARDPDE4BACACB
SCHEMBL10021071 0.82 KDM1A (0.34) KDM1AFFAR1PPARDACACB
SCHEMBL10021419 0.81 KDM1A (0.36) KDM1AFFAR1PPARDACACBALDH1A1
SCHEMBL10021495 0.78 KDM1A (0.35) KDM1AFFAR1PPARDACACBALDH1A1
SCHEMBL16130591 0.78 FFAR1 (0.32) FFAR1PPARDACACBALDH1A1FFAR4
SCHEMBL10021190 0.76 FFAR1 (0.37) KDM1AFFAR1PDE4B
SCHEMBL10021064 0.76 KDM1A (0.32) KDM1A
SCHEMBL10021474 0.75 FFAR1 (0.33) KDM1AFFAR1PPARDACACB
SCHEMBL14960952 0.75 PTGES (0.31) FFAR1PPARDACACB
SCHEMBL12740674 0.74 FFAR1 (0.41) KDM1AFFAR1PPARD

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