SCHEMBL5854432

SCHEMBL5854432

COC(=O)c1cccc(N2C(=O)OCC2C(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RX3 P56373 10/20 0.50
P2RX2 Q9UBL9 10/20 0.50
GAA P10253 1/20 0.49
GRM2 Q14416 1/20 0.45
TP53 P04637 1/20 0.43
IDH1 O75874 3/20 0.43

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
SCHEMBL5854429 1.00 P2RX3 (0.50) P2RX3P2RX2GAAGRM2TP53
SCHEMBL5853254 0.86 P2RX3 (0.53) P2RX3P2RX2GAAIDH1
SCHEMBL5853264 0.86 P2RX3 (0.53) P2RX3P2RX2GAAIDH1
SCHEMBL5855065 0.77 PIK3CA (0.47) GAAGRM2IDH1
SCHEMBL5855070 0.77 PIK3CA (0.47) GAAGRM2IDH1
SCHEMBL1936824 0.77 IDH1 (0.44) P2RX3P2RX2IDH1
SCHEMBL28627879 0.74 LMNA (0.42) TP53IDH1
SCHEMBL2366383 0.73 P2RX3 (0.48) P2RX3P2RX2IDH1
SCHEMBL2366332 0.73 P2RX3 (0.48) P2RX3P2RX2IDH1
SCHEMBL2366328 0.73 P2RX3 (0.48) P2RX3P2RX2IDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6992103-B2 Benzamide derivatives, processes for their preparation, and their pharmaceutical use SMITHKLINE BEECHAM P.L.C. (GB) 2006-01-31 US disclosed
US-20050085520-A1 Benzamide derivatives, processes for their preparation, and their pharmaceutical use SMITHKLINE BEECHAM P.L.C. (GB) 2005-04-21 US disclosed
EP-1448520-A1 BENZAMIDE DERIVATIVES, PROCESSES FOR THEIR PREPARATION, AND THEIR PHARMACEUTICAL USE SMITHKLINE BEECHAM PLC (GB) 2004-08-25 EP disclosed
WO-2003045913-A1 BENZAMIDE DERIVATIVES, PROCESSES FOR THEIR PREPARATION, AND THEIR PHARMACEUTICAL USE SMITHKLINE BEECHAM P.L.C. (GB) 2003-06-05 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-20050085520-A1 Benzamide derivatives, processes for their preparation, and their pharmaceutical use BACE2, PSEN2, BACE1 P2RX3 2716/4885P2RX2 1574/4885GAA 13/4885

“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.