SCHEMBL4983018

SCHEMBL4983018

COc1ccc(CN2CCc3[c]nc(C(N)=O)nc3C2)cc1OC

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.45
KDM4E B2RXH2 4/20 0.45
MEN1 O00255 3/20 0.45
TP53 P04637 1/20 0.45
MAPK1 P28482 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
ACHE P22303 1/20 0.44
ABCB1 P08183 1/20 0.42
LMNA P02545 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
FAAH O00519 1/20 0.41
PKM P14618 1/20 0.41

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
SCHEMBL4986695 0.93 KDM4E (0.52) KMT2AKDM4EMEN1TP53MAPK1
SCHEMBL4984986 0.92 GRM2 (0.43) KMT2AKDM4EMEN1ABCB1ALDH1A1
SCHEMBL4985287 0.91 NPC1 (0.54) KMT2AKDM4EMEN1MAPK1LMNA
SCHEMBL4987158 0.90 MAPK1 (0.51) KMT2AKDM4EMEN1MAPK1LMNA
SCHEMBL4985321 0.88 CFTR (0.44) ABCB1MAPTPKM
SCHEMBL4985028 0.86 KDM4E (0.45) KMT2AKDM4EMEN1ALDH1A1MAPT
SCHEMBL4985019 0.86 CA9 (0.40) KMT2AKDM4EMEN1ALDH1A1MAPT
SCHEMBL4989469 0.86 GRM2 (0.40) KMT2AMEN1FAAH
SCHEMBL4982516 0.86 DHFR (0.45) KMT2AMEN1TP53ABCB1LMNA
SCHEMBL4986738 0.85 HSP90AB1 (0.45) KMT2AKDM4EMEN1ACHELMNA

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-20080039478-A1 Bicycloheteroaryl Compounds as P2X7 Modulators and Uses Thereof RENOVIS, INC. 2008-02-14 US claimed
US-7297700-B2 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof RENOVIS, INC. (US) 2007-11-20 US claimed

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-20080039478-A1 Bicycloheteroaryl Compounds as P2X7 Modulators and Uses Thereof P2RX7, P2RX3, P2RX2 KMT2A 4614/4885KDM4E 4128/4885MEN1 4853/4885

“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.