SCHEMBL2723980

SCHEMBL2723980

CC(C)(C)OC(=O)c1cccc(Nc2c(C(N)=O)cnc3cc(Br)ccc23)c1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.59
ERBB2 P04626 2/20 0.59
CSF1R P07333 14/20 0.56
PDE4B Q07343 3/20 0.52
LRRK2 Q5S007 1/20 0.46
AURKB Q96GD4 1/20 0.46

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
SCHEMBL2723375 0.87 KDM4E (0.59) EGFRERBB2CSF1RPDE4BAURKB
SCHEMBL2723483 0.85 CSF1R (0.67) EGFRERBB2CSF1RPDE4B
SCHEMBL2723970 0.81 CSF1R (0.58) EGFRERBB2CSF1RPDE4B
SCHEMBL2723611 0.77 PDE4B (0.71) EGFRERBB2CSF1RPDE4BAURKB
SCHEMBL15054394 0.76 AURKB (0.51) EGFRERBB2CSF1RAURKB
SCHEMBL2723683 0.76 KDM4E (0.59) CSF1RPDE4BAURKB
SCHEMBL2723821 0.75 CSF1R (0.58) EGFRERBB2CSF1RPDE4B
SCHEMBL15053963 0.75 CSF1R (0.58) EGFRERBB2CSF1RPDE4B
SCHEMBL5929711 0.74 EGFR (1.00) EGFRERBB2CSF1R
SCHEMBL15054323 0.74 CSF1R (0.55) EGFRERBB2CSF1RPDE4B

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 3 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-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 1772/4885ERBB2 1287/4885CSF1R 2683/4885

“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.