SCHEMBL4989124

SCHEMBL4989124

NC(=O)c1n[c]c2c(n1)CN(C(=O)c1ccccc1Cl)CC2

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
HPGD P15428 2/20 0.50
LMNA P02545 1/20 0.50
HTT P42858 1/20 0.50
RXFP1 Q9HBX9 1/20 0.44
P2RX7 Q99572 13/20 0.44
RAB9A P51151 2/20 0.41
TP53 P04637 1/20 0.39
UBE2M P61081 1/20 0.39
DCUN1D1 Q96GG9 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HSD17B10 Q99714 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
SCHEMBL4980888 0.92 P2RX7 (0.52) P2RX7
SCHEMBL4988440 0.88 MAPK14 (0.44) ALDH1A1HPGDLMNAHTTP2RX7
SCHEMBL4988879 0.87 P2RX7 (0.48) P2RX7
SCHEMBL4982578 0.87 HTT (0.50) ALDH1A1HPGDHTTP2RX7
SCHEMBL4986225 0.87 GRM5 (0.46) ALDH1A1LMNAHTTTP53UBE2M
SCHEMBL4980769 0.86 POLB (0.44) LMNAP2RX7RAB9A
SCHEMBL4982536 0.85 P2RX7 (0.39) LMNAP2RX7
SCHEMBL4988101 0.84 HTT (0.46) ALDH1A1HTTKDM4EHSD17B10
SCHEMBL4985376 0.84 P2RX7 (0.45) P2RX7
SCHEMBL4985620 0.84 PTGS1 (0.43) HPGD

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 ALDH1A1 3640/4885HPGD 368/4885LMNA 1911/4885

“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.