SCHEMBL4988685

SCHEMBL4988685

N#Cc1cccc(C(=O)N2CCc3c(N)ncnc3C2)c1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 8/20 0.52
ELANE P08246 1/20 0.41
P2RX7 Q99572 4/20 0.41
NAMPT P43490 1/20 0.41
SLC6A7 Q99884 1/20 0.40
JAK2 O60674 2/20 0.40
JAK1 P23458 1/20 0.40
PRLHR P49683 2/20 0.40
JAK3 P52333 1/20 0.40
PDE2A O00408 1/20 0.40

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
SCHEMBL4984728 0.87 GRM5 (0.47) GRM5P2RX7SLC6A7PRLHRPDE2A
SCHEMBL4992289 0.84 GRM5 (0.49) GRM5P2RX7
SCHEMBL4989748 0.84 SMN1; SMN2 (0.55) GRM5P2RX7
SCHEMBL4983101 0.84 HPGD (0.49) GRM5P2RX7
SCHEMBL4985380 0.83 ALDH1A1 (0.51) GRM5
SCHEMBL4985624 0.83 P2RX7 (0.49) GRM5P2RX7
SCHEMBL4984930 0.81 P2RX7 (0.56) GRM5P2RX7
SCHEMBL4985525 0.81 HSD11B1 (0.47) GRM5P2RX7SLC6A7PDE2A
SCHEMBL4988578 0.79 TSHR (0.47) GRM5P2RX7
SCHEMBL14272293 0.78 TSHR (0.50) GRM5ELANENAMPTJAK2JAK1

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 231/4885ELANE 1304/4885P2RX7 1/4885

“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.