SCHEMBL8373378

SCHEMBL8373378

CC(C)(N)c1cc(C(=O)NC2(C(=O)NCc3cccc(C(F)(F)F)c3)CCCCC2)cc(C(C)(C)N)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.48
CYP2C19 P33261 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
PLA2G1B P04054 1/20 0.48
CYP1A2 P05177 1/20 0.48
GAA P10253 1/20 0.48
CYP2D6 P10635 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
ATG4B Q9Y4P1 1/20 0.48
CYP2C9 P11712 1/20 0.48
MLYCD O95822 1/20 0.47
BDKRB1 P46663 1/20 0.46
CACNA1G O43497 1/20 0.45
CACNA1H O95180 1/20 0.45
CACNA1I Q9P0X4 1/20 0.45
CTSL P07711 3/20 0.43
CTSS P25774 3/20 0.43
CTSB P07858 2/20 0.43
MAPK14 Q16539 1/20 0.43

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
SCHEMBL4392920 0.93 CYP3A4 (0.49) CYP3A4CYP2C19MEN1KMT2APLA2G1B
SCHEMBL7857640 0.92 CYP3A4 (0.50) CYP3A4CYP2C19MEN1KMT2APLA2G1B
SCHEMBL7857643 0.89 CTSL (0.47) CYP3A4CYP2C19MEN1KMT2APLA2G1B
SCHEMBL7856572 0.88 CYP3A4 (0.45) CYP3A4CYP2C19MEN1KMT2APLA2G1B
SCHEMBL7856578 0.88 CYP3A4 (0.46) CYP3A4CYP2C19MEN1KMT2APLA2G1B
SCHEMBL7855810 0.85 CTSL (0.52) CYP3A4CYP2C19MEN1KMT2APLA2G1B
SCHEMBL8376780 0.85 CTSL (0.47) CYP3A4CYP2C19MEN1KMT2APLA2G1B
SCHEMBL7855740 0.84 CYP3A4 (0.47) CYP3A4CYP2C19MEN1KMT2APLA2G1B
SCHEMBL7855813 0.83 MLYCD (0.48) CYP3A4CYP2C19MEN1KMT2APLA2G1B
SCHEMBL7857659 0.83 CTSL (0.48) CYP3A4CYP2C19MEN1KMT2APLA2G1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009132453-A1 CYCLYLAMINE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS NEUROMED PHARMACEUTICALS LTD. (CA) 2009-11-05 WO disclosed
US-20090270394-A1 CYCLYLAMINE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS ZALICUS PHARMACEUTICALS LTD. (CA) 2009-10-29 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-20090270394-A1 CYCLYLAMINE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS CACNA1G, CACNA1H, CACNA1I CYP3A4 1644/4885CYP2C19 2621/4885MEN1 2191/4885

“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.