SCHEMBL2985178

SCHEMBL2985178

CC(=O)OC(C)(C)C(=O)NC1CCC(Cc2ccccc2)(N2CCCCC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 1/20 0.39
DPP7 Q9UHL4 1/20 0.38
CNR2 P34972 2/20 0.38
KMT2A Q03164 3/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
EPHX1 P07099 1/20 0.37
HPGD P15428 1/20 0.37
CHRM2 P08172 3/20 0.37
CHRM1 P11229 3/20 0.37
CHRM3 P20309 3/20 0.37
OPRM1 P35372 2/20 0.37
EPHX2 P34913 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
RAB9A P51151 1/20 0.36
MEN1 O00255 2/20 0.36
CCR1 P32246 1/20 0.36
OPRL1 P41146 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL2989160 0.80 OPRM1 (0.43) SSTR4CNR2KMT2AL3MBTL1EPHX1
SCHEMBL2989357 0.80 TSHR (0.46) KMT2AHPGDMEN1CCR1MAPT
SCHEMBL2987472 0.79 NPSR1 (0.48) KMT2AL3MBTL1HPGDOPRM1EPHX2
SCHEMBL4871841 0.77 L3MBTL1 (0.47) L3MBTL1
SCHEMBL4871937 0.77 SCN9A (0.52) L3MBTL1
SCHEMBL2985459 0.76 POLB (0.59) KMT2AHPGDRAB9AMEN1
SCHEMBL2983320 0.76 POLB (0.59) KMT2AHPGDRAB9AMEN1
SCHEMBL2989191 0.76 TSHR (0.49) KMT2AHPGDRAB9AMEN1MAPT
SCHEMBL2989174 0.76 PPARA (0.54) CHRM1RAB9AMAPT
SCHEMBL2982591 0.75 TSHR (0.50) KMT2AHPGDRAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7786328-B2 Cyclohexyl-1,4-diamine compounds GRUENENTHAL GMBH (DE) 2010-08-31 US claimed
US-20070281954-A1 Cyclohexyl-1,4-diamine compounds GRUENENTHAL GMBH (DE) 2007-12-06 US claimed
US-7786328-B2 Cyclohexyl-1,4-diamine compounds GRUENENTHAL GMBH (DE) 2010-08-31 US disclosed
US-20070281954-A1 Cyclohexyl-1,4-diamine compounds GRUENENTHAL GMBH (DE) 2007-12-06 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-20070281954-A1 Cyclohexyl-1,4-diamine compounds DPYD, PKD1, AOC1 SSTR4 1326/4885DPP7 156/4885CNR2 716/4885

“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.