SCHEMBL4986041

SCHEMBL4986041

Nc1ncnc2c1CCN(C(=O)c1ccc(Cl)c(Cl)c1)C2

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.49
PKM P14618 1/20 0.46
P2RX7 Q99572 14/20 0.45
TACR3 P29371 1/20 0.42

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
SCHEMBL4988057 0.87 P2RX7 (0.45) HPGDP2RX7
SCHEMBL4992289 0.86 GRM5 (0.49) HPGDPKMP2RX7
SCHEMBL4984765 0.86 P2RX7 (0.44) P2RX7
SCHEMBL4988859 0.84 P2RX7 (0.43) P2RX7
SCHEMBL4984815 0.84 GRM5 (0.48) P2RX7TACR3
SCHEMBL4985119 0.84 HPGD (0.57) HPGDP2RX7
SCHEMBL4988578 0.83 TSHR (0.47) HPGDP2RX7
SCHEMBL4982979 0.82 GRM5 (0.50) P2RX7
SCHEMBL4990817 0.82 PKM (0.46) HPGDPKMP2RX7TACR3
SCHEMBL4985624 0.82 P2RX7 (0.49) HPGDP2RX7

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 HPGD 368/4885PKM 1098/4885P2RX7 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.