SCHEMBL4278102

SCHEMBL4278102

CC(N)(C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1)C(c1ccccc1)c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.72
MEN1 O00255 1/20 0.72
MAOB P27338 1/20 0.55
MAPT P10636 5/20 0.54
NPSR1 Q6W5P4 4/20 0.54
KDM4E B2RXH2 2/20 0.54
HPGD P15428 1/20 0.54
ALDH1A1 P00352 6/20 0.52
CACNA2D1 P54289 3/20 0.52
CACNA1B Q00975 3/20 0.52
CACNB1 Q02641 3/20 0.52
CACNA1C Q13936 3/20 0.52
CACNA1H O95180 1/20 0.52
LMNA P02545 1/20 0.52
MGLL Q99685 1/20 0.51
USP2 O75604 1/20 0.49
MAPK1 P28482 1/20 0.49

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
SCHEMBL4273981 0.93 KMT2A (0.62) KMT2AMEN1ALDH1A1CACNA2D1CACNA1B
SCHEMBL4273008 0.93 KMT2A (0.62) KMT2AMEN1MAOBMAPTNPSR1
SCHEMBL4286415 0.89 CACNA2D1 (0.60) KMT2AMEN1MAOBMAPTNPSR1
SCHEMBL4273986 0.88 CACNA2D1 (0.60) KMT2AMEN1MAPTKDM4EALDH1A1
SCHEMBL5140571 0.83 KMT2A (0.72) KMT2AMEN1MAOBMAPTNPSR1
SCHEMBL4273020 0.80 CACNA2D1 (0.62) KMT2AMEN1ALDH1A1CACNA2D1CACNA1B
SCHEMBL4908979 0.78 KMT2A (0.64) KMT2AMEN1MAOBMAPTNPSR1
SCHEMBL4270394 0.77 ALDH1A1 (0.49) KMT2AMEN1MAPTNPSR1KDM4E
SCHEMBL8695618 0.76 CYP2D6 (0.46) KMT2AMEN1MAPTNPSR1KDM4E
SCHEMBL13994872 0.76 KMT2A (1.00) KMT2AMEN1MAOBMAPTNPSR1

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-20090221603-A1 HETEROCYCLIC AMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS ZALICUS PHARMACEUTICALS LTD. (CA) 2009-09-03 US claimed
EP-1976841-A1 HETEROCYCLIC AMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS Neuromed Pharmaceuticals, Ltd. (CA) 2008-10-08 EP claimed
WO-2007071035-A1 HETEROCYCLIC AMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS NEUROMED PHARMACEUTICALS LTD. (CA) 2007-06-28 WO claimed
US-20090221603-A1 HETEROCYCLIC AMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS ZALICUS PHARMACEUTICALS LTD. (CA) 2009-09-03 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-20090221603-A1 HETEROCYCLIC AMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS RYR2, CACNA1E, RYR1 KMT2A 2235/4885MEN1 3119/4885MAOB 878/4885

“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.