SCHEMBL1413075

SCHEMBL1413075

O=C(NCCc1ccccc1Cl)c1nc(-n2ncc(=O)[nH]c2=O)ccc1Cl

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 11/20 0.67
ABCB11 O95342 1/20 0.67
HIF1A Q16665 2/20 0.43
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 1/20 0.42
TP53 P04637 2/20 0.42
RIPK1 Q13546 1/20 0.41
TRPV1 Q8NER1 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
SCHEMBL1412941 0.89 P2RX7 (0.54) P2RX7ABCB11TRPV1
SCHEMBL1412892 0.83 P2RX7 (0.49) P2RX7ABCB11HIF1AKDM4EMEN1
SCHEMBL7085991 0.82 P2RX7 (0.50) P2RX7ABCB11MEN1MAPTKMT2A
SCHEMBL1413016 0.82 P2RX7 (0.75) P2RX7ABCB11HIF1A
SCHEMBL1412983 0.81 P2RX7 (0.48) P2RX7ABCB11TP53
SCHEMBL1412901 0.80 P2RX7 (1.00) P2RX7ABCB11
SCHEMBL1412882 0.79 P2RX7 (0.68) P2RX7ABCB11HIF1AKDM4EMEN1
SCHEMBL7085989 0.78 P2RX7 (0.46) P2RX7ABCB11KDM4EMEN1ALDH1A1
SCHEMBL1412952 0.77 P2RX7 (0.79) P2RX7ABCB11TP53
SCHEMBL1412897 0.76 P2RX7 (0.84) P2RX7ABCB11KDM4EMEN1ALDH1A1

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
EP-1448535-B1 BENZAMIDE AND HETEROARYLAMIDE AS P2X7 RECEPTOR ANTAGONISTS PFIZER PROD INC (US) 2011-03-16 EP disclosed
US-20030186981-A1 Benzamide, heteroarylamide and reverse amides PFIZER INC. 2003-10-02 US 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-20030186981-A1 Benzamide, heteroarylamide and reverse amides P2RX7, P2RX5, P2RX2 P2RX7 1/4885ABCB11 866/4885HIF1A 59/4885

“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.