SCHEMBL19092145

SCHEMBL19092145

CC(C)(C)NC(=O)CN1C[C@H]2CC[C@@H]1C[C@@H](CNC(=O)C1(c3ccccc3)CCCC1)C2

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 18/20 0.52
KCNH2 Q12809 1/20 0.43
CACNA1I Q9P0X4 1/20 0.43
OPRL1 P41146 1/20 0.42

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
SCHEMBL19092109 0.91 CACNA1H (0.55) CACNA1HKCNH2CACNA1I
SCHEMBL19082642 0.88 CACNA1H (0.65) CACNA1H
SCHEMBL4278224 0.80 CACNA1I (0.60) CACNA1HKCNH2CACNA1IOPRL1
SCHEMBL19082615 0.79 CACNA1H (0.68) CACNA1H
SCHEMBL4271317 0.73 CACNA1I (0.60) CACNA1HKCNH2CACNA1I
SCHEMBL20725563 0.73 SMN1; SMN2 (0.48) CACNA1HKCNH2CACNA1IOPRL1
SCHEMBL22018882 0.71 CACNA1I (0.51) CACNA1HKCNH2CACNA1I
SCHEMBL26082220 0.71 CACNA1I (0.74) CACNA1HKCNH2CACNA1IOPRL1
SCHEMBL19082624 0.68 CACNA1H (1.00) CACNA1H
SCHEMBL26082223 0.67 CACNA1I (0.68) CACNA1HKCNH2CACNA1IOPRL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170190699-A1 SUBSTITUTED TROPANE DERIVATIVES TOA EIYO LTD. (JP) 2017-07-06 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-20170190699-A1 SUBSTITUTED TROPANE DERIVATIVES CACNA1G, CACNA1H, CACNA1I CACNA1H 2/4885KCNH2 68/4885CACNA1I 3/4885

“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.