SCHEMBL8009231

SCHEMBL8009231

Cc1ccc(CC2CCC(=O)C(CN(C)C)C2)cc1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 2/20 0.38
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
GAA P10253 1/20 0.36
MCHR1 Q99705 1/20 0.35
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
OPRM1 P35372 1/20 0.34
FAAH O00519 1/20 0.34
PTGS1 P23219 2/20 0.33
PTGS2 P35354 2/20 0.33
KMT2A Q03164 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
OPRK1 P41145 1/20 0.33
HTT P42858 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
MEN1 O00255 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
Hydrochloric Acid SCHEMBL8615828 0.99 METAP1 (0.40) METAP1NPC1RAB9AGAAMCHR1
SCHEMBL8023959 0.87 ALDH1A1 (0.42) METAP1GAALMNAKMT2AMEN1
Hydrochloric Acid SCHEMBL8615141 0.86 ALDH1A1 (0.41) METAP1GAALMNAKMT2AMEN1
SCHEMBL8025758 0.74 METAP1 (0.38) METAP1
Hydrochloric Acid SCHEMBL8616461 0.73 METAP1 (0.39) METAP1
SCHEMBL8008639 0.72 OPRM1 (0.42) RAB9ALMNAOPRM1FAAHL3MBTL1
SCHEMBL8019882 0.72 SIGMAR1 (0.35) METAP1
Hydrochloric Acid SCHEMBL8615192 0.71 CCR6 (0.35) METAP1
SCHEMBL24969105 0.70 ALDH1A1 (0.47) METAP1GAAMCHR1SMN1; SMN2KMT2A
SCHEMBL7623394 0.69 NPC1 (0.57) NPC1RAB9AGAALMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0780369-B1 1-Phenyl-2-dimethylaminomethyl-cyclohexan-1-ol derivatives as pharmaceutical agents GRUENENTHAL GMBH (DE) 2000-01-19 EP disclosed
EP-0780369-A1 1-Phenyl-2-dimethylaminomethyl-cyclohexan-1-ol derivatives as pharmaceutical agents Grünenthal GmbH (DE) 1997-06-25 EP disclosed