SCHEMBL4509934

SCHEMBL4509934

COc1ccc(CCNC(=O)C=C(C)c2ccc3oc(C(=O)c4ccc(C#N)cc4)c(NC(=O)c4cnoc4C)c3c2)cc1OC

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.44
CYSLTR1 Q9Y271 1/20 0.44
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 6/20 0.36
ALDH1A1 P00352 4/20 0.36
USP2 O75604 1/20 0.36
MAPK1 P28482 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TP53 P04637 1/20 0.36
THRB P10828 1/20 0.36
LMNA P02545 1/20 0.35
KDM4E B2RXH2 2/20 0.35
RXFP1 Q9HBX9 1/20 0.35

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
SCHEMBL4509932 1.00 CYSLTR2 (0.44) CYSLTR2CYSLTR1KMT2AMEN1SMN1; SMN2
SCHEMBL4509927 1.00 CYSLTR2 (0.44) CYSLTR2CYSLTR1KMT2AMEN1SMN1; SMN2
SCHEMBL4498688 0.90 KMT2A (0.42) KMT2AMEN1SMN1; SMN2POLBMAPT
SCHEMBL4495126 0.84 MAPT (0.39) KMT2AMEN1SMN1; SMN2POLBMAPT
SCHEMBL4510714 0.80 CYSLTR2 (0.68) CYSLTR2CYSLTR1SMN1; SMN2POLBMAPT
SCHEMBL4510711 0.80 CYSLTR2 (0.68) CYSLTR2CYSLTR1SMN1; SMN2POLBMAPT
SCHEMBL4510706 0.80 CYSLTR2 (0.68) CYSLTR2CYSLTR1SMN1; SMN2POLBMAPT
SCHEMBL4494666 0.77 CYSLTR2 (0.47) CYSLTR2CYSLTR1KMT2AMEN1SMN1; SMN2
SCHEMBL4494669 0.77 CYSLTR2 (0.47) CYSLTR2CYSLTR1KMT2AMEN1SMN1; SMN2
SCHEMBL4494673 0.77 CYSLTR2 (0.47) CYSLTR2CYSLTR1KMT2AMEN1SMN1; SMN2

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
US-7638540-B2 Benzofuran compound and medicinal composition containing the same THE NEW INDUSTRY RESEARCH ORGANIZATION (JP) 2009-12-29 US disclosed
US-20060194851-A1 Benzofuran compound and medicinal composition containing the same NEW INDUSTRY RESEARCH ORGANIZATION, THE (JP) 2006-08-31 US disclosed
EP-1627873-A1 BENZOFURAN COMPOUND AND MEDICINAL COMPOSITION CONTAINING THE SAME The New Industry Research Organization (JP) 2006-02-22 EP 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-20060194851-A1 Benzofuran compound and medicinal composition containing the same LTB4R2, LTC4S, LTB4R CYSLTR2 4/4885CYSLTR1 5/4885KMT2A 312/4885

“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.