SCHEMBL4495508

SCHEMBL4495508

C/C=C(/C(N)=O)C(C)c1cc2cccc(OC)c2o1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.56
ALDH1A1 P00352 2/20 0.56
ADORA2A P29274 2/20 0.52
ADORA2B P29275 2/20 0.52
ADORA1 P30542 1/20 0.52
LMNA P02545 1/20 0.51
RECQL P46063 1/20 0.51
MAPT P10636 4/20 0.51
MEN1 O00255 3/20 0.51
CA12 O43570 2/20 0.48
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
CA9 Q16790 2/20 0.48
CA3 P07451 1/20 0.48
CA4 P22748 1/20 0.48
CA6 P23280 1/20 0.48
CA5A P35218 1/20 0.48
CA7 P43166 1/20 0.48
CA14 Q9ULX7 1/20 0.48
CA5B Q9Y2D0 1/20 0.48

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
SCHEMBL4495521 1.00 KMT2A (0.56) KMT2AALDH1A1ADORA2AADORA2BADORA1
SCHEMBL2397463 0.76 KMT2A (0.58) KMT2AALDH1A1ADORA2AADORA2BADORA1
SCHEMBL29793869 0.75 KMT2A (0.55) KMT2AALDH1A1ADORA2AADORA2BADORA1
SCHEMBL21788603 0.75 KMT2A (0.55) KMT2AALDH1A1ADORA2AADORA2BADORA1
SCHEMBL4495517 0.75 KMT2A (0.53) KMT2AALDH1A1ADORA2AADORA2BADORA1
SCHEMBL4495511 0.75 KMT2A (0.53) KMT2AALDH1A1ADORA2AADORA2BADORA1
SCHEMBL25062632 0.75 CYP2A6 (0.57) KMT2AALDH1A1ADORA2AADORA2BADORA1
SCHEMBL13600942 0.73 MAPT (0.53) KMT2AALDH1A1ADORA2AADORA2BADORA1
SCHEMBL4495518 0.73 MAPT (0.53) KMT2AALDH1A1ADORA2AADORA2BADORA1
SCHEMBL11354104 0.73 LMNA (0.55) KMT2AALDH1A1ADORA2AADORA2BADORA1

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 KMT2A 312/4885ALDH1A1 658/4885ADORA2A 2453/4885

“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.