SCHEMBL2978761

SCHEMBL2978761

CN(C)C1(Cc2ccc(Cl)cc2)CCC(NC(=O)COc2ccc(Cl)cc2)CC1

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ATF4 P18848 6/20 0.65
KMT2A Q03164 2/20 0.50
LMNA P02545 2/20 0.49
MEN1 O00255 1/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47
RECQL P46063 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
ALDH1A1 P00352 1/20 0.46

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
SCHEMBL2977860 0.96 ATF4 (0.60) ATF4KMT2ALMNAMEN1POLB
SCHEMBL2987483 0.95 ATF4 (0.61) ATF4KMT2ALMNAMEN1POLB
SCHEMBL2987178 0.90 ATF4 (0.58) ATF4KMT2ALMNAPOLB
SCHEMBL2981298 0.88 ATF4 (0.56) ATF4KMT2ALMNAMEN1POLB
SCHEMBL2972810 0.87 ATF4 (0.55) ATF4KMT2ALMNAPOLB
SCHEMBL2985870 0.86 ATF4 (0.59) ATF4KMT2ALMNAMEN1POLB
SCHEMBL2989096 0.86 ATF4 (0.58) ATF4KMT2ALMNAMEN1ALDH1A1
SCHEMBL2981361 0.85 ATF4 (0.57) ATF4KMT2ALMNAMEN1POLB
SCHEMBL2972824 0.84 ATF4 (0.59) ATF4KMT2ALMNAMEN1POLB
SCHEMBL2983764 0.84 LMNA (0.58) ATF4KMT2ALMNAMEN1POLB

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-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
EP-1747191-A1 SUBSTITUTED CYCLOHEXYL-1,4-DIAMINE DERIVATIVES WITH A CHAIN EXTENSION Grünenthal GmbH (DE) 2007-01-31 EP disclosed
WO-2005110975-A1 SUBSTITUTED CYCLOHEXYL-1,4-DIAMINE DERIVATIVES WITH A CHAIN EXTENSION Grünenthal GmbH (DE) 2005-11-24 WO 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 ATF4 1845/4885KMT2A 3786/4885LMNA 1459/4885

“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.