SCHEMBL4988052

SCHEMBL4988052

NC(=O)c1n[c]c2c(n1)CN(C(=O)c1ccc(Cl)cc1)CC2

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSP90AB1 P08238 1/20 0.42
HSD17B10 Q99714 3/20 0.40
GRM5 P41594 1/20 0.39
ALDH1A1 P00352 2/20 0.39
HPGD P15428 2/20 0.39
POLB P06746 1/20 0.39
PHGDH O43175 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
GLA P06280 1/20 0.39
PRLHR P49683 7/20 0.38
MAPT P10636 2/20 0.37
F2 P00734 1/20 0.37
KMT2A Q03164 1/20 0.37
MGLL Q99685 1/20 0.37

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) HSP90AB1GRM5MAPTF2
SCHEMBL4990813 0.89 PKM (0.42) GRM5ALDH1A1HPGDMAPTKMT2A
SCHEMBL4982974 0.89 GRM5 (0.45) HSP90AB1GRM5CA12CA1CA2
SCHEMBL4985620 0.88 PTGS1 (0.43) GRM5HPGD
SCHEMBL4986032 0.88 HPGD (0.45) HPGDKMT2A
SCHEMBL4985116 0.87 HPGD (0.52) HSP90AB1GRM5HPGDMAPT
SCHEMBL4992284 0.87 GRM5 (0.48) GRM5ALDH1A1CA12CA1CA2
SCHEMBL4984723 0.87 GRM5 (0.43) GRM5ALDH1A1PRLHR
SCHEMBL4983028 0.86 HPGD (0.44) ALDH1A1HPGDKMT2A
SCHEMBL4989566 0.86 GAA (0.45) HPGDPHGDHPRLHRKMT2A

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 HSP90AB1 1175/4885HSD17B10 4009/4885GRM5 231/4885

“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.