SCHEMBL4491271

SCHEMBL4491271

CCN(CC)C(=O)C=C(C)c1ccc2oc(C(C)=O)c(NC(=O)c3cnoc3C)c2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.50
CYSLTR1 Q9Y271 1/20 0.50
RAB9A P51151 3/20 0.36
NPC1 O15118 2/20 0.36
LTB4R Q15722 11/20 0.35
LTB4R2 Q9NPC1 11/20 0.35
NPSR1 Q6W5P4 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
LMNA P02545 2/20 0.34
TP53 P04637 2/20 0.34
GMNN O75496 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
HTR1A P08908 1/20 0.34
THRB P10828 1/20 0.34
PIM1 P11309 1/20 0.34
CYP2C9 P11712 1/20 0.34
MAOA P21397 1/20 0.34
SLC6A2 P23975 1/20 0.34
HTR2A P28223 1/20 0.34

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
SCHEMBL4491258 1.00 CYSLTR2 (0.50) CYSLTR2CYSLTR1RAB9ANPC1LTB4R
SCHEMBL4491265 1.00 CYSLTR2 (0.50) CYSLTR2CYSLTR1RAB9ANPC1LTB4R
SCHEMBL4515599 0.94 CYSLTR2 (0.51) CYSLTR2CYSLTR1RAB9ANPC1LTB4R
SCHEMBL4515586 0.94 CYSLTR2 (0.51) CYSLTR2CYSLTR1RAB9ANPC1LTB4R
SCHEMBL4515594 0.94 CYSLTR2 (0.51) CYSLTR2CYSLTR1RAB9ANPC1LTB4R
SCHEMBL13600901 0.92 CYSLTR2 (0.48) CYSLTR2CYSLTR1RAB9ANPSR1SMN1; SMN2
SCHEMBL4510714 0.88 CYSLTR2 (0.68) CYSLTR2CYSLTR1RAB9ANPSR1SMN1; SMN2
SCHEMBL4510711 0.88 CYSLTR2 (0.68) CYSLTR2CYSLTR1RAB9ANPSR1SMN1; SMN2
SCHEMBL4510706 0.88 CYSLTR2 (0.68) CYSLTR2CYSLTR1RAB9ANPSR1SMN1; SMN2
SCHEMBL13600998 0.86 MAPT (0.50) CYSLTR2CYSLTR1RAB9ANPC1NPSR1

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 5/4885RAB9A 4698/4885

“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.