SCHEMBL1328396

SCHEMBL1328396

CN(C)C(c1cccc(F)c1)C1CCC(CCNC(=O)c2ccc(Cl)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 3/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
CHRM4 P08173 3/20 0.42
SNCA P37840 1/20 0.40
OPRM1 P35372 2/20 0.40
SLC6A9 P48067 1/20 0.40
SLC6A5 Q9Y345 1/20 0.40
IDO1 P14902 1/20 0.40
CNR1 P21554 1/20 0.39
OPRD1 P41143 1/20 0.39
OPRK1 P41145 1/20 0.39
TMEM97 Q5BJF2 1/20 0.39
SIGMAR1 Q99720 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
SCHEMBL1328256 0.93 SLC6A9 (0.47) OPRL1CHRM4OPRM1SLC6A9SLC6A5
SCHEMBL1328495 0.92 GRM5 (0.45) OPRL1MEN1KMT2AOPRM1TMEM97
SCHEMBL1327818 0.89 OPRL1 (0.42) OPRL1CHRM4OPRM1SLC6A9SLC6A5
SCHEMBL1327393 0.88 CHRM4 (0.46) RAB9AMEN1KMT2ACHRM4SLC6A9
SCHEMBL1327297 0.88 TMEM97 (0.47) CHRM4TMEM97SIGMAR1
SCHEMBL1326898 0.87 KCNK3 (0.43) OPRL1NPC1RAB9AKMT2AOPRM1
SCHEMBL27751828 0.86 SCD (0.45) OPRL1NPC1RAB9ACHRM4OPRM1
SCHEMBL1327983 0.86 P2RX7 (0.42) OPRL1NPC1RAB9ASIGMAR1
SCHEMBL1328090 0.85 CACNA1H (0.40) CHRM4IDO1CNR1
SCHEMBL1328124 0.85 OPRL1 (0.42) OPRL1NPC1RAB9ACHRM4OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8058475-B2 Substituted cyclohexylmethyl compounds GRUENENTHAL GMBH (DE) 2011-11-15 US claimed
EP-1989174-B1 SUBSTITUTED CYCLOHEXYLMETHYL DERIVATIVES GRUENENTHAL GMBH (DE) 2011-08-03 EP claimed
US-20090286833-A1 Substituted Cyclohexylmethyl Compounds GRUENENTHAL GMBH (DE) 2009-11-19 US claimed
US-8058475-B2 Substituted cyclohexylmethyl compounds GRUENENTHAL GMBH (DE) 2011-11-15 US disclosed
EP-1989174-B1 SUBSTITUTED CYCLOHEXYLMETHYL DERIVATIVES GRUENENTHAL GMBH (DE) 2011-08-03 EP disclosed
US-20090286833-A1 Substituted Cyclohexylmethyl Compounds GRUENENTHAL GMBH (DE) 2009-11-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090286833-A1 Substituted Cyclohexylmethyl Compounds CNR1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, C1R OPRL1 238/4885NPC1 112/4885RAB9A 905/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.