SCHEMBL4753091

SCHEMBL4753091

Nc1ccnn1-c1cccc(Cl)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
P2RX7 Q99572 16/20 0.45
DRD2 P14416 2/20 0.39
DRD3 P35462 2/20 0.39
ADRB1 P08588 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
SCHEMBL10992734 0.85 POLB (0.55) POLBADRB1
Hydrochloric Acid SCHEMBL11473793 0.84 POLB (0.53) POLB
SCHEMBL9458558 0.84 POLB (0.44) POLBP2RX7
SCHEMBL17844034 0.79 POLB (0.52) POLBP2RX7
SCHEMBL27955916 0.75 P2RX7 (0.42) P2RX7
SCHEMBL15428572 0.71 POLB (0.43) POLB
SCHEMBL9818549 0.71 POLB (0.52) POLB
SCHEMBL27971656 0.71 POLB (0.47) POLBP2RX7
SCHEMBL13172113 0.71 CYP1A2 (0.51) POLBP2RX7
SCHEMBL15428731 0.70 POLB (0.55) POLB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1963275-A2 P2X7 RECEPTOR ANTAGONISTS AND USES THEREOF Abbott Laboratories (US) 2008-09-03 EP disclosed
US-20070259920-A1 P2X7, receptor antagonists and uses thereof ABBOTT LABORATORIES 2007-11-08 US disclosed
WO-2007056091-A2 2-PHENYL-2H-PYRAZ0LE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS AND USES THEREOF ABBOTT LABORATORIES (US) 2007-05-18 WO disclosed

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-20070259920-A1 P2X7, receptor antagonists and uses thereof P2RX7, P2RX1, P2RX3 POLB 4437/4885P2RX7 1/4885DRD2 950/4885

“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.