SCHEMBL6665035

SCHEMBL6665035

CCCCCC1CCC(c2ccc(COC(F)(F)Cc3ccc(OC(F)(F)F)cc3)cc2)CC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 11/20 0.38
KDM1A O60341 1/20 0.36
RCOR1 Q9UKL0 1/20 0.36
CARM1 Q86X55 1/20 0.36
PRMT6 Q96LA8 1/20 0.36
TSHR P16473 1/20 0.36
CYP2C9 P11712 1/20 0.35
HDAC3 O15379 1/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
SPHK2 Q9NRA0 7/20 0.34
ESR2 Q92731 1/20 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
SCHEMBL6668744 0.99 SPHK1 (0.40) SPHK1KDM1ARCOR1CARM1PRMT6
SCHEMBL6663972 0.99 SPHK1 (0.40) SPHK1KDM1ARCOR1CARM1PRMT6
SCHEMBL6664070 0.99 SPHK1 (0.40) SPHK1KDM1ARCOR1CARM1PRMT6
SCHEMBL6661293 0.99 SPHK1 (0.40) SPHK1KDM1ARCOR1CARM1PRMT6
SCHEMBL6666573 0.99 SPHK1 (0.40) SPHK1KDM1ARCOR1CARM1PRMT6
SCHEMBL6665374 0.97 KDM1A (0.37) SPHK1KDM1ARCOR1CARM1PRMT6
SCHEMBL6660741 0.92 SPHK1 (0.44) SPHK1CYP2C9SPHK2ESR2
SCHEMBL6661887 0.90 CYP2C9 (0.44) SPHK1CYP2C9SPHK2ESR2
SCHEMBL6667375 0.90 CYP2C9 (0.44) SPHK1CYP2C9SPHK2ESR2
SCHEMBL6660749 0.89 SPHK1 (0.41) SPHK1CYP2C9SPHK2ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0893423-B1 LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORP (JP) 2004-09-01 EP disclosed