SCHEMBL11283757

SCHEMBL11283757

CCCCCCCCCCCCC1CCC(c2ccc(-c3ccc(OCC)cc3)cc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 3/20 0.42
RAB9A P51151 3/20 0.41
MAPT P10636 3/20 0.41
GAA P10253 1/20 0.41
CYP2C9 P11712 2/20 0.41
NPC1 O15118 1/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
NLRP3 Q96P20 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
DGAT1 O75907 1/20 0.39
S1PR3 Q99500 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39

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
SCHEMBL11278024 1.00 SPHK1 (0.42) SPHK1RAB9AMAPTGAACYP2C9
SCHEMBL11277687 1.00 SPHK1 (0.42) SPHK1RAB9AMAPTGAACYP2C9
SCHEMBL11288172 1.00 SPHK1 (0.42) SPHK1RAB9AMAPTGAACYP2C9
SCHEMBL11282569 1.00 SPHK1 (0.42) SPHK1RAB9AMAPTGAACYP2C9
SCHEMBL11285843 1.00 SPHK1 (0.42) SPHK1RAB9AMAPTGAACYP2C9
SCHEMBL11280685 1.00 SPHK1 (0.42) SPHK1RAB9AMAPTGAACYP2C9
SCHEMBL11280006 0.99 RAB9A (0.42) SPHK1RAB9AMAPTGAACYP2C9
SCHEMBL11285546 0.94 RAB9A (0.43) SPHK1RAB9AMAPTCYP2C9NPC1
SCHEMBL8455532 0.94 RAB9A (0.45) SPHK1RAB9AMAPTGAACYP2C9
SCHEMBL1890879 0.94 RAB9A (0.45) SPHK1RAB9AMAPTGAACYP2C9

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