SCHEMBL20876268

SCHEMBL20876268

CNC(=O)c1cc(C(=O)OC)ccc1O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.62
CA1 P00915 5/20 0.62
CA2 P00918 5/20 0.62
CA7 P43166 5/20 0.62
CA9 Q16790 5/20 0.62
CA14 Q9ULX7 5/20 0.62
XDH P47989 2/20 0.62
HSD17B10 Q99714 5/20 0.56
KDM4E B2RXH2 4/20 0.56
HPGD P15428 4/20 0.56
MAPT P10636 3/20 0.56
LMNA P02545 3/20 0.56
ALDH1A1 P00352 3/20 0.56
TP53 P04637 2/20 0.56
ALOX15 P16050 2/20 0.56
ALOX12 P18054 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
MEN1 O00255 1/20 0.56
HTT P42858 1/20 0.56
KMT2A Q03164 1/20 0.56

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
SCHEMBL403210 0.85 CA12 (0.71) CA12CA1CA2CA7CA9
SCHEMBL13830580 0.85 CA12 (0.61) CA12CA1CA2CA7CA9
SCHEMBL25827162 0.83 ALDH1A1 (0.49) CA12CA1CA2CA7CA9
SCHEMBL27780497 0.82 NEU3 (0.54) CA12CA1CA2CA7CA9
SCHEMBL670644 0.82 CA1 (0.67) CA12CA1CA2CA7CA9
SCHEMBL29826125 0.82 CA1 (0.67) CA12CA1CA2CA7CA9
SCHEMBL136284 0.82 CA1 (0.67) CA12CA1CA2CA7CA9
SCHEMBL31251101 0.81 KDM4E (0.54) CA12CA1CA2CA7CA9
SCHEMBL552572 0.81 CA12 (0.65) CA12CA1CA2CA7CA9
SCHEMBL23080087 0.79 HSP90AA1 (0.56) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3692026-B1 BENZOFURAN DERIVATIVES AND THEIR USE AS BROMODOMAIN INHIBITORS. GLAXOSMITHKLINE IP NO 2 LTD (GB) 2022-07-06 EP disclosed
EP-3692026-B1 BENZOFURAN DERIVATIVES AND THEIR USE AS BROMODOMAIN INHIBITORS. GLAXOSMITHKLINE IP NO 2 LTD (GB) 2022-07-06 EP disclosed
US-11273146-B2 Benzofuran derivatives and their use as bromodomain inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2022-03-15 US disclosed
US-11273146-B2 Benzofuran derivatives and their use as bromodomain inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2022-03-15 US disclosed
US-20200289464-A1 BENZOFURAN DERIVATIVES AND THEIR USE AS BROMODOMAIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2020-09-17 US disclosed
US-20200289464-A1 BENZOFURAN DERIVATIVES AND THEIR USE AS BROMODOMAIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2020-09-17 US disclosed
EP-3692026-A1 BENZOFURAN DERIVATIVES AND THEIR USE AS BROMODOMAIN INHIBITORS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2020-08-12 EP disclosed
WO-2019068783-A1 BENZOFURAN DERIVATIVES AND THEIR USE AS BROMODOMAIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2019-04-11 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-20200289464-A1 BENZOFURAN DERIVATIVES AND THEIR USE AS BROMODOMAIN INHIBITORS BRD4, BRD3, BRPF3 CA12 4138/4885CA1 3586/4885CA2 2391/4885
US-11273146-B2 Benzofuran derivatives and their use as bromodomain inhibitors BRD4, BRD3, BRPF3 CA12 4138/4885CA1 3586/4885CA2 2391/4885

“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.