SCHEMBL1367535

SCHEMBL1367535

O=C(c1cc2cccc(F)c2[nH]c1=O)c1cc2cccc(F)c2[nH]c1=O

nearest known ligand 0.66

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DAO P14920 6/20 0.66
DDO Q99489 3/20 0.66
CA12 O43570 1/20 0.50
CA9 Q16790 1/20 0.50
HRH4 Q9H3N8 6/20 0.46
KDM4E B2RXH2 1/20 0.40
HSD17B10 Q99714 1/20 0.40
AR P10275 1/20 0.39

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
SCHEMBL27348185 0.89 DAO (0.64) DAODDOCA12CA9HRH4
SCHEMBL1369128 0.81 DAO (0.50) DAODDOKDM4EHSD17B10
SCHEMBL4196645 0.80 DAO (0.71) DAODDOCA12CA9HRH4
SCHEMBL1367893 0.79 HRH4 (0.42) DAODDOHRH4
SCHEMBL3362300 0.79 DAO (1.00) DAODDOCA12CA9HRH4
SCHEMBL27856030 0.77 HRH4 (0.60) DAODDOCA12CA9HRH4
SCHEMBL19145380 0.76 DAO (0.52) DAODDOCA12CA9HRH4
SCHEMBL12970395 0.76 DAO (0.65) DAODDOCA12CA9HRH4
SCHEMBL31378708 0.76 DAO (0.65) DAODDOCA12CA9HRH4
SCHEMBL1370450 0.75 APEX1 (0.61) HRH4KDM4EHSD17B10

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
US-20090275650-A1 3-Acyl coumarins, thiochromones and quinolones and therapeutic uses thereof TEMPLE UNIVERSITY- OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2009-11-05 US claimed
WO-2006132947-A2 3-ACYL COUMARINS, THIOCHROMONES AND QUINOLONES AND THERAPEUTIC USES THEREOF TEMPLE UNIVERSITY- OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2006-12-14 WO claimed
US-8067461-B2 3-acyl coumarins, thiochromones and quinolones and therapeutic uses thereof TEMPLE UNIVERSITY-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2011-11-29 US disclosed
US-20090275650-A1 3-Acyl coumarins, thiochromones and quinolones and therapeutic uses thereof TEMPLE UNIVERSITY- OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2009-11-05 US disclosed
WO-2006132947-A2 3-ACYL COUMARINS, THIOCHROMONES AND QUINOLONES AND THERAPEUTIC USES THEREOF TEMPLE UNIVERSITY- OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2006-12-14 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-20090275650-A1 3-Acyl coumarins, thiochromones and quinolones and therapeutic uses thereof NQO2, NQO1, HCCS DAO 3402/4885DDO 3116/4885CA12 4005/4885

“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.