SCHEMBL1326720

SCHEMBL1326720

CN(C)C(c1cccs1)C1CCC(NC(=O)Cc2ccc(Cl)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.57
POLB P06746 5/20 0.51
SIGMAR1 Q99720 2/20 0.47
GRM7 Q14831 1/20 0.46
TP53 P04637 2/20 0.45
KDM4E B2RXH2 2/20 0.44
MAPT P10636 1/20 0.44
TDP1 Q9NUW8 2/20 0.43
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
EPHX2 P34913 2/20 0.40
OPRM1 P35372 1/20 0.39
OPRL1 P41146 1/20 0.39
ALDH1A1 P00352 1/20 0.39
ATF4 P18848 1/20 0.39
GAA P10253 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
SCHEMBL1327211 0.87 POLB (0.49) LMNAPOLBTP53KDM4EMAPT
SCHEMBL494017 0.84 RAB9A (0.41) POLBOPRM1ALDH1A1GAA
SCHEMBL1326686 0.84 LMNA (0.61) LMNAPOLBSIGMAR1GRM7KMT2A
SCHEMBL1327826 0.83 RAB9A (0.40) POLBKDM4EOPRM1ALDH1A1GAA
SCHEMBL1327451 0.81 L3MBTL1 (0.42) KDM4EKMT2AMEN1ALDH1A1
SCHEMBL493420 0.80 LMNA (0.38) LMNAPOLBTP53MAPTTDP1
SCHEMBL494016 0.79 OPRM1 (0.41) TP53KDM4EMAPTTDP1KMT2A
SCHEMBL1328006 0.78 PLK1 (0.39) LMNASIGMAR1KMT2AMEN1ALDH1A1
SCHEMBL1328192 0.78 LMNA (0.54) LMNAPOLBSIGMAR1GRM7EPHX2
SCHEMBL2306265 0.78 OPRM1 (0.39) TP53KDM4EMAPTKMT2AMEN1

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 LMNA 1432/4885POLB 3017/4885SIGMAR1 174/4885

“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.