SCHEMBL7109864

SCHEMBL7109864

CCCCCCCCOc1cnc(-c2ccc(O)c(F)c2)nc1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 6/20 0.46
FAAH O00519 2/20 0.46
CNR1 P21554 2/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.46
KDM4E B2RXH2 1/20 0.46
NR5A1 Q13285 1/20 0.44
RARB P10826 3/20 0.44
MCL1 Q07820 1/20 0.44
MAPT P10636 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
PLA2G2A P14555 1/20 0.40
TP53 P04637 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL9198614 1.00 MGLL (0.46) MGLLFAAHCNR1NPC1RAB9A
SCHEMBL9197034 0.91 RARB (0.50) MGLLFAAHCNR1NPC1RAB9A
SCHEMBL6249403 0.85 MGLL (0.46) MGLLFAAHCNR1
SCHEMBL9181458 0.85 KDM4E (0.52) MGLLFAAHCNR1NPC1RAB9A
SCHEMBL9663860 0.83 NR5A1 (0.57) MGLLFAAHCNR1NR5A1RARB
SCHEMBL8774093 0.83 NR5A1 (0.57) MGLLFAAHCNR1NR5A1RARB
SCHEMBL8024977 0.83 RARB (0.58) MGLLFAAHCNR1NPC1RAB9A
SCHEMBL9046108 0.83 RARB (0.58) MGLLFAAHCNR1NPC1RAB9A
SCHEMBL9198829 0.83 RARB (0.58) MGLLFAAHCNR1NPC1RAB9A
SCHEMBL8420898 0.83 RARB (0.58) MGLLFAAHCNR1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1042302-B1 LIQUID CRYSTAL COMPOUNDS HAVING A CHIRAL FLUORINATED TERMINAL PORTION MINNESOTA MINING & MFG (US) 2003-09-24 EP disclosed
US-5972241-A ELECTROOPTICAL APPLICATIONS, IN PARTICULAR THOSE WHICH REQUIRE COMPACT, ENERGY-EFFICIENT, VOLTAGE-CONTROLLED LIGHT VALVES, E.G., WATCHES AND COMPUTERS 3M INNOVATIVE PROPERTIES COMPANY (US) 1999-10-26 US disclosed
US-5928562-A HAVING EXTENDED HYDROCARBON ETHER GROUP ADJACENT TO A TERMINAL FLUOROALKYL OR FLUOROETHER GROUP; LOW VISCOSITY; HIGH SPEED RESPONSE; BRIGHTNESS; COMMPATIBILITY; DISPLAYS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-07-27 US disclosed
EP-0469893-B1 Fluorinated pyrimidine-phenyl optically active compounds and liquid crystal compositions thereof TAKASAGO PERFUMERY CO LTD (JP) 1995-12-13 EP disclosed
US-5422037-A For electro-optical and display devices DISPLAYTECH, INC. (US) 1995-06-06 US disclosed
US-5275756-A Pyrimidine ether compounds for electrooptical elements TAKASAGO INTERNATIONAL CORPORATION (JP) 1994-01-04 US disclosed
EP-0469893-A1 Fluorinated pyrimidine-phenyl optically active compounds and liquid crystal compositions thereof Takasago International Corporation (JP) 1992-02-05 EP disclosed