SCHEMBL1328192

SCHEMBL1328192

CN(C)C(c1cccc(F)c1)C1CCC(NC(=O)Cc2ccc(Cl)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.54
POLB P06746 1/20 0.48
OPRL1 P41146 3/20 0.47
SIGMAR1 Q99720 8/20 0.46
GRM7 Q14831 1/20 0.44
IDO1 P14902 1/20 0.43
EPHX2 P34913 1/20 0.42
CNR2 P34972 1/20 0.42
PKM P14618 1/20 0.42
TSHR P16473 1/20 0.42
CCR2 P41597 1/20 0.42
OPRM1 P35372 1/20 0.41

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
SCHEMBL1326636 0.91 SIGMAR1 (0.54) OPRL1SIGMAR1EPHX2CNR2PKM
SCHEMBL1326686 0.87 LMNA (0.61) LMNAPOLBOPRL1SIGMAR1GRM7
SCHEMBL492896 0.87 ATF4 (0.57) LMNAOPRL1
SCHEMBL1328149 0.82 OPRL1 (0.49) OPRL1SIGMAR1CCR2OPRM1
SCHEMBL2307830 0.82 GRM5 (0.47) OPRL1
SCHEMBL493344 0.80 OPRL1 (0.45) LMNAOPRL1SIGMAR1CNR2PKM
SCHEMBL493055 0.80 OPRL1 (0.39) LMNAOPRL1
SCHEMBL1327179 0.79 TAS1R3 (0.46) OPRL1
SCHEMBL27751632 0.79 HPGD (0.51) OPRL1IDO1
SCHEMBL1326720 0.78 LMNA (0.57) LMNAPOLBOPRL1SIGMAR1GRM7

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 8 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
CN-101384544-A Substituted cyclohexylmethyl derivatives GRUENENTHAL GMBH (DE) 2009-03-11 CN 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
CN-101384544-A Substituted cyclohexylmethyl derivatives GRUENENTHAL GMBH (DE) 2009-03-11 CN 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 LMNA 1432/4885POLB 3017/4885OPRL1 238/4885

“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.