SCHEMBL1412939

SCHEMBL1412939

Cc1ccc(C(NC(=O)c2cc(-n3ncc(=O)[nH]c3=O)ncc2Cl)C2CCCCC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD17B1 P14061 1/20 0.48
HSD17B2 P37059 1/20 0.48
P2RX7 Q99572 9/20 0.46
THRB P10828 3/20 0.42
PDE2A O00408 4/20 0.38
AKT1 P31749 1/20 0.38
GRM5 P41594 1/20 0.36
GCG P01275 1/20 0.36

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
SCHEMBL1413043 0.92 P2RX7 (0.47) HSD17B1HSD17B2P2RX7THRB
SCHEMBL1412884 0.87 P2RX7 (0.62) HSD17B1HSD17B2P2RX7THRBAKT1
SCHEMBL1412963 0.86 P2RX7 (0.49) HSD17B1HSD17B2P2RX7THRBPDE2A
SCHEMBL1412887 0.84 P2RX7 (0.49) P2RX7THRB
SCHEMBL1413013 0.84 P2RX7 (0.40) P2RX7THRBPDE2AAKT1
SCHEMBL1412926 0.79 P2RX7 (0.64) P2RX7THRB
SCHEMBL1412899 0.78 P2RX7 (0.38) P2RX7THRBPDE2A
SCHEMBL1415262 0.78 P2RX7 (0.62) P2RX7THRB
SCHEMBL5390136 0.77 P2RX7 (0.50) P2RX7THRB
SCHEMBL5838248 0.77 HSD17B1 (0.50) HSD17B1HSD17B2P2RX7PDE2AAKT1

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 7 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-7235549-B2 Benzamide, heteroarylamide and reverse amides PFIZER INC. (US) 2007-06-26 US disclosed
US-7214677-B2 Benzamide, heteroarylamide and reverse amides PFIZER INC. (US) 2007-05-08 US disclosed
US-20060058302-A1 Benzamide, heteroarylamide and reverse amides PFIZER INC. 2006-03-16 US disclosed
EP-1448535-A1 BENZAMIDE AND HETEROARYLAMIDE AS P2X7 RECEPTOR ANTAGONISTS Pfizer Products Inc. (US) 2004-08-25 EP disclosed
US-20030186981-A1 Benzamide, heteroarylamide and reverse amides PFIZER INC. 2003-10-02 US disclosed
WO-2003042191-A1 BENZAMIDE AND HETEROARYLAMIDE AS P2X7 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2003-05-22 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 (2 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 HSD17B1 4642/4885HSD17B2 4762/4885P2RX7 1/4885
US-20060058302-A1 Benzamide, heteroarylamide and reverse amides P2RX7, P2RX5, P2RX2 HSD17B1 4743/4885HSD17B2 4713/4885P2RX7 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.