SCHEMBL2984841

SCHEMBL2984841

Cc1ccccc1CC1(N(C)C)CCC(NC(=O)COc2ccccc2)CC1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
POLB P06746 1/20 0.48
MAPK1 P28482 1/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
ALDH1A1 P00352 3/20 0.47
TSHR P16473 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MAPT P10636 1/20 0.45
HPGD P15428 1/20 0.45
HTT P42858 1/20 0.45
RAB9A P51151 1/20 0.45
ATF4 P18848 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C19 P33261 1/20 0.44

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
SCHEMBL2989096 0.92 ATF4 (0.58) LMNASMN1; SMN2MAPK1MEN1KMT2A
SCHEMBL2985188 0.89 MEN1 (0.50) SMN1; SMN2MEN1KMT2AMAPTHPGD
SCHEMBL2985326 0.88 HPGD (0.50) LMNASMN1; SMN2POLBMAPK1MEN1
SCHEMBL2987316 0.88 POLB (0.50) LMNASMN1; SMN2POLBMAPK1MEN1
SCHEMBL2974336 0.88 MEN1 (0.46) POLBMEN1KMT2AALDH1A1TSHR
SCHEMBL2985108 0.85 OPRM1 (0.45) MEN1KMT2AALDH1A1TSHRHSD17B10
SCHEMBL2985870 0.82 ATF4 (0.59) LMNASMN1; SMN2POLBMAPK1MEN1
SCHEMBL2981330 0.82 POLB (0.51) LMNASMN1; SMN2POLBMAPK1MEN1
SCHEMBL2983764 0.82 LMNA (0.58) LMNASMN1; SMN2POLBMAPK1MEN1
SCHEMBL2987360 0.81 TSHR (0.50) SMN1; SMN2POLBMAPK1ALDH1A1TSHR

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 LMNA 1459/4885SMN1; SMN2 895/4885POLB 1844/4885

“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.