SCHEMBL11279196

SCHEMBL11279196

CCCCC1CCC(c2ccc(-c3ccc(OC(F)(F)C(F)(F)F)cc3)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.39
MEN1 O00255 2/20 0.38
MAPK1 P28482 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 2/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
ESR2 Q92731 2/20 0.35
RAB9A P51151 1/20 0.35
SPHK1 Q9NYA1 3/20 0.35
DRD2 P14416 2/20 0.35
GAA P10253 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HRH3 Q9Y5N1 1/20 0.33
DRD1 P21728 1/20 0.33
DRD4 P21917 1/20 0.33
DRD5 P21918 1/20 0.33
DRD3 P35462 1/20 0.33
KDM1A O60341 1/20 0.33
RCOR1 Q9UKL0 1/20 0.33

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
SCHEMBL11277003 0.96 CYP2C9 (0.39) CYP2C9MEN1MAPK1KMT2AMAPT
SCHEMBL11289729 0.95 SPHK1 (0.39) CYP2C9MEN1MAPK1KMT2AMAPT
SCHEMBL11282359 0.95 SPHK1 (0.39) CYP2C9MEN1MAPK1KMT2AMAPT
SCHEMBL11278085 0.95 SPHK1 (0.39) CYP2C9MEN1MAPK1KMT2AMAPT
SCHEMBL11276014 0.95 SPHK1 (0.39) CYP2C9MEN1MAPK1KMT2AMAPT
SCHEMBL11277810 0.95 SPHK1 (0.39) CYP2C9MEN1MAPK1KMT2AMAPT
SCHEMBL9340699 0.95 CYP2C9 (0.41) CYP2C9MEN1MAPK1KMT2AMAPT
SCHEMBL11288425 0.93 CYP2C9 (0.38) CYP2C9MEN1MAPK1KMT2AMAPT
SCHEMBL9336696 0.92 CYP2C9 (0.39) CYP2C9MEN1MAPK1KMT2AMAPT
SCHEMBL9336685 0.92 CYP2C9 (0.39) CYP2C9MEN1MAPK1KMT2AMAPT

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
US-4330426-A Cyclohexylbiphenyls, their preparation and use in dielectrics and electrooptical display elements MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1982-05-18 US disclosed