SCHEMBL7794853

SCHEMBL7794853

CC1(C)CCCN1C(=O)CN[C@H]1CC[C@@H](CNC(=O)c2cc(F)cc(Cl)c2)CC1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 7/20 0.53
CACNA1I Q9P0X4 12/20 0.50
CACNA1G O43497 1/20 0.50
KCNH2 Q12809 8/20 0.42
MCHR1 Q99705 2/20 0.40

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
SCHEMBL4277721 1.00 CACNA1H (0.53) CACNA1HCACNA1ICACNA1GKCNH2MCHR1
SCHEMBL4277714 1.00 CACNA1H (0.53) CACNA1HCACNA1ICACNA1GKCNH2MCHR1
SCHEMBL8372292 0.89 CACNA1H (0.41) CACNA1HCACNA1ICACNA1GMCHR1
SCHEMBL7800297 0.88 KMT2A (0.41) CACNA1HCACNA1ICACNA1GMCHR1
SCHEMBL4271293 0.88 KMT2A (0.41) CACNA1HCACNA1ICACNA1GMCHR1
SCHEMBL4271298 0.88 KMT2A (0.41) CACNA1HCACNA1ICACNA1GMCHR1
SCHEMBL4280037 0.87 CACNA1H (0.53) CACNA1HCACNA1ICACNA1GKCNH2
SCHEMBL7794321 0.87 CACNA1H (0.53) CACNA1HCACNA1ICACNA1GKCNH2
SCHEMBL4280042 0.87 CACNA1H (0.53) CACNA1HCACNA1ICACNA1GKCNH2
SCHEMBL26082504 0.85 CACNA1I (0.64) CACNA1HCACNA1ICACNA1GKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009146539-A1 4-(AMINOMETHYL)CYCLOHEXANAMINE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS NEUROMED PHARMACEUTICALS LTD. (CA) 2009-12-10 WO disclosed
US-20090298834-A1 4-(AMINOMETHYL)CYCLOHEXANAMINE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS ZALICUS PHARMACEUTICALS LTD. (CA) 2009-12-03 US disclosed
US-20090298834-A1 4-(AMINOMETHYL)CYCLOHEXANAMINE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS ZALICUS PHARMACEUTICALS LTD. (CA) 2009-12-03 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-20090298834-A1 4-(AMINOMETHYL)CYCLOHEXANAMINE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS CACNA1G, CACNA1I, CACNA1H CACNA1H 3/4885CACNA1I 2/4885CACNA1G 1/4885

“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.