SCHEMBL4992284

SCHEMBL4992284

NC(=O)c1n[c]c2c(n1)CN(C(=O)c1cccc(Cl)c1)CC2

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 6/20 0.48
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
PKM P14618 1/20 0.43
PTGDR2 Q9Y5Y4 3/20 0.43
CYP2D6 P10635 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
ALDH1A1 P00352 3/20 0.40
PARP1 P09874 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PTGDR Q13258 1/20 0.40
PDE4B Q07343 1/20 0.39

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
SCHEMBL4988856 0.89 GRM5 (0.39) GRM5CYP1A2CYP3A4
SCHEMBL4983097 0.88 GRM5 (0.48) GRM5CYP3A4PARP1L3MBTL1
SCHEMBL4989744 0.88 ALDH1A1 (0.51) GRM5CA12CA1CA2CA7
SCHEMBL4988052 0.87 HSP90AB1 (0.42) GRM5CA12CA1CA2CA7
SCHEMBL4985620 0.87 PTGS1 (0.43) GRM5PTGDR2
SCHEMBL4986032 0.86 HPGD (0.45) PKM
SCHEMBL4988678 0.86 GRM5 (0.52) GRM5CYP3A4
SCHEMBL4984763 0.85 PROKR1 (0.39) GRM5
SCHEMBL4985375 0.85 GRM5 (0.51) GRM5CYP3A4CA12CA1CA2
SCHEMBL4984928 0.85 GRM5 (0.51) GRM5

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 GRM5 231/4885CYP1A2 1172/4885CYP3A4 1221/4885

“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.