SCHEMBL11287630

SCHEMBL11287630

CCCCCCC1CCC(c2ccc(-c3ccc(OC)cc3)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.49
SPHK1 Q9NYA1 3/20 0.43
MAPT P10636 2/20 0.42
GAA P10253 1/20 0.42
CYP2C9 P11712 1/20 0.42
GRM2 Q14416 1/20 0.41
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 2/20 0.40
MAPK1 P28482 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 1/20 0.40
DGAT1 O75907 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MGLL Q99685 2/20 0.38

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
SCHEMBL10659015 1.00 DRD2 (0.49) DRD2SPHK1MAPTGAACYP2C9
SCHEMBL11286368 1.00 DRD2 (0.49) DRD2SPHK1MAPTGAACYP2C9
SCHEMBL11283921 1.00 DRD2 (0.49) DRD2SPHK1MAPTGAACYP2C9
SCHEMBL11279457 1.00 DRD2 (0.49) DRD2SPHK1MAPTGAACYP2C9
SCHEMBL11282229 1.00 DRD2 (0.49) DRD2SPHK1MAPTGAACYP2C9
SCHEMBL11283709 1.00 DRD2 (0.49) DRD2SPHK1MAPTGAACYP2C9
SCHEMBL223652 0.99 DRD2 (0.50) DRD2SPHK1MAPTGAACYP2C9
SCHEMBL222090 0.99 DRD2 (0.50) DRD2SPHK1MAPTGAACYP2C9
SCHEMBL21321779 0.97 DRD2 (0.49) DRD2SPHK1MAPTGAACYP2C9
SCHEMBL21321988 0.96 DRD2 (0.52) DRD2SPHK1MAPTGAACYP2C9

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