SCHEMBL2723767

SCHEMBL2723767

COc1cc2c(O)c(C(=O)O)cnc2cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EGFR P00533 3/20 0.50
CSF1R P07333 11/20 0.45
MAPT P10636 2/20 0.44
GAA P10253 1/20 0.44
THRB P10828 1/20 0.44
ERBB2 P04626 1/20 0.44
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
NUDT1 P36639 2/20 0.41
MEN1 O00255 1/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41
PDE5A O76074 1/20 0.41

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
SCHEMBL24311984 0.89 EGFR (0.52) EGFRCSF1RMAPTGAATHRB
SCHEMBL6143695 0.88 EGFR (0.53) EGFRCSF1RERBB2NUDT1
SCHEMBL24311983 0.88 GAA (0.48) EGFRCSF1RMAPTGAATHRB
SCHEMBL28524305 0.84 ALDH1A1 (0.49) EGFRMAPTTHRBKDM4EALDH1A1
SCHEMBL29617332 0.84 ALDH1A1 (0.49) EGFRMAPTTHRBKDM4EALDH1A1
SCHEMBL3871505 0.83 EGFR (0.50) EGFRCSF1RERBB2NUDT1HTT
SCHEMBL2725474 0.83 MAPT (0.60) MAPTGAATHRBKDM4EALDH1A1
Hydrochloric Acid SCHEMBL6084967 0.82 EGFR (0.49) EGFRCSF1RERBB2NUDT1HTT
SCHEMBL7165177 0.81 EGFR (0.58) EGFRCSF1RERBB2NUDT1
SCHEMBL31554519 0.81 EGFR (0.58) EGFRCSF1RERBB2NUDT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2635279-A2 CHEMICAL COMPOUNDS Glaxosmithkline Intellectual Property (No. 2) Limited (GB) 2013-09-11 EP disclosed
US-20130225524-A1 Chemical Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2013-08-29 US disclosed
WO-2013096151-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2013-06-27 WO disclosed
WO-2013096151-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2013-06-27 WO disclosed
WO-2012061557-A2 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2012-05-10 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-20130225524-A1 Chemical Compounds LDHA, NQO2, LDHB EGFR 1772/4885CSF1R 2683/4885MAPT 3144/4885

“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.