SCHEMBL3346147

SCHEMBL3346147

CNC(=O)Cn1nc(C(N)=O)c2cc(C)[c]cc21

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.39
CFD P00746 16/20 0.36
MAPK8 P45983 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
PKM P14618 1/20 0.35

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
SCHEMBL3341780 0.83 NPSR1 (0.39) CFD
SCHEMBL3345159 0.81 CCNA2 (0.36) CFDMAPK8
SCHEMBL3343808 0.73 CNR1 (0.31)
SCHEMBL1744676 0.72 RAB9A (0.39) RAB9AMAPK8
SCHEMBL3343370 0.67 CCNA2 (0.34)
SCHEMBL15542380 0.65 CFD (0.46) RAB9ACFDKDM4E
SCHEMBL14703621 0.65 MAPT (0.40) RAB9AALDH1A1
SCHEMBL12480475 0.64 CFD (0.51) CFD
SCHEMBL19086857 0.63 ALDH1A1 (0.55) RAB9AKDM4EALDH1A1PKM
SCHEMBL3345732 0.62 BRD4 (0.34) KDM4E

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-8372865-B2 Dihydropyridone amides as P2X7 modulators ROCHE PALO ALTO LLC (US) 2013-02-12 US disclosed
US-20100160373-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS ROCHE PALO ALTO LLC 2010-06-24 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-20100160373-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS P2RY1, P2RX3, P2RX1 RAB9A 1696/4885CFD 4421/4885MAPK8 1906/4885

“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.