SCHEMBL11285293

SCHEMBL11285293

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

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
CYP2C9 P11712 1/20 0.40
MEN1 O00255 2/20 0.39
MAPK1 P28482 2/20 0.39
KMT2A Q03164 2/20 0.39
ESR2 Q92731 1/20 0.36
SPHK1 Q9NYA1 3/20 0.35
DGAT1 O75907 1/20 0.35
SOAT1 P35610 1/20 0.35
GAA P10253 2/20 0.34
P2RY14 Q15391 1/20 0.34
HTR2C P28335 2/20 0.34
CNR2 P34972 3/20 0.34
CYP1A2 P05177 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
SCHEMBL11284077 0.96 MAPT (0.40) MAPTALDH1A1LMNACYP2C9MEN1
SCHEMBL11275636 0.96 MAPT (0.40) MAPTALDH1A1LMNACYP2C9MEN1
SCHEMBL11284263 0.95 MAPT (0.40) MAPTALDH1A1LMNACYP2C9MEN1
SCHEMBL11286676 0.95 MAPT (0.40) MAPTALDH1A1LMNACYP2C9MEN1
SCHEMBL11283730 0.95 MAPT (0.40) MAPTALDH1A1LMNACYP2C9MEN1
SCHEMBL11280300 0.95 MAPT (0.40) MAPTALDH1A1LMNACYP2C9MEN1
SCHEMBL11278507 0.95 MAPT (0.40) MAPTALDH1A1LMNACYP2C9MEN1
SCHEMBL11285554 0.95 MAPT (0.40) MAPTALDH1A1LMNACYP2C9MEN1
SCHEMBL11278845 0.92 MAPT (0.40) MAPTALDH1A1LMNACYP2C9MEN1
SCHEMBL11280593 0.92 ALDH1A1 (0.49) MAPTALDH1A1LMNACYP2C9MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0022183-B1 DERIVATIVES OF CYCLOHEXYLBIPHENYL, PROCESS FOR THEIR PREPARATION, DIELECTRICS CONTAINING THEM, AND ELECTRON OPTICAL INDICATING ELEMENTS MERCK PATENT GmbH (DE) 1982-06-23 EP disclosed
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
EP-0022183-A2 Derivatives of cyclohexylbiphenyl, process for their preparation, dielectrics containing them, and electron optical indicating elements MERCK PATENT GmbH (DE) 1981-01-14 EP disclosed