SCHEMBL16624295

SCHEMBL16624295

CC(C)N1CCc2c([nH]c3cc(Cl)ccc23)C1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
ATM Q13315 2/20 0.45
GAA P10253 1/20 0.45
KDM4E B2RXH2 1/20 0.44
TRPV1 Q8NER1 6/20 0.43
BAZ2B Q9UIF8 2/20 0.42
TP53 P04637 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
RCE1 Q9Y256 1/20 0.40
MAPK10 P53779 1/20 0.39
RIPK1 Q13546 1/20 0.39
MCHR1 Q99705 1/20 0.39
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38

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
SCHEMBL17993835 0.84 KDM4E (0.46) KDM4ETRPV1BAZ2B
SCHEMBL1120432 0.84 KDM4E (0.64) MEN1KMT2AATMGAAKDM4E
SCHEMBL17993837 0.83 ADRA1A (0.45) MEN1KMT2AKDM4ETRPV1BAZ2B
SCHEMBL18033535 0.83 KDM4E (0.44) MEN1KMT2AKDM4ETRPV1BAZ2B
SCHEMBL17993875 0.81 MEN1 (0.55) MEN1KMT2AATMGAATRPV1
SCHEMBL16624099 0.81 HTR7 (0.58) MEN1KMT2AATMGAAKDM4E
SCHEMBL16624095 0.80 KIF11 (0.46) KDM4ETRPV1MAPK10RIPK1MCHR1
SCHEMBL8261111 0.79 KDM4E (0.69) MEN1KMT2AKDM4ETRPV1
SCHEMBL5376602 0.77 TRPV1 (0.56) MEN1KMT2ATRPV1BAZ2BMAPT
SCHEMBL11670415 0.77 BAZ2B (0.53) MEN1KMT2AGAAKDM4EBAZ2B

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
US-20160237071-A1 T-TYPE CALCIUM CHANNEL INHIBITOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2016-08-18 US disclosed
WO-2015050212-A1 T-TYPE CALCIUM CHANNEL BLOCKER 日産化学工業株式会社 2015-04-09 WO 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-20160237071-A1 T-TYPE CALCIUM CHANNEL INHIBITOR CACNA1I, CACNA1G, CACNA1H MEN1 1968/4885KMT2A 4070/4885ATM 4228/4885

“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.