SCHEMBL1369128

SCHEMBL1369128

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 6/20 0.50
DDO Q99489 3/20 0.50
SPR P35270 1/20 0.44
MAOA P21397 3/20 0.41
GRIN2D O15399 2/20 0.41
GRIN2A Q12879 2/20 0.41
GRIN2B Q13224 2/20 0.41
GRIN2C Q14957 2/20 0.41
MAOB P27338 2/20 0.41
KDM4E B2RXH2 4/20 0.41
TDP1 Q9NUW8 1/20 0.41
HSD17B10 Q99714 2/20 0.40
GAA P10253 1/20 0.38
PKM P14618 1/20 0.38
GRIN3B O60391 1/20 0.37
GRIN1 Q05586 1/20 0.37
GRIN3A Q8TCU5 1/20 0.37
ALDH1A1 P00352 2/20 0.37
LCK P06239 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL31423096 0.87 LCK (0.48) DAODDOMAOAGRIN2DGRIN2A
Zinc Ion SCHEMBL1452758 0.85 DAO (0.46) DAODDOSPRMAOAGRIN2D
SCHEMBL1452771 0.85 DAO (0.46) DAODDOSPRMAOAGRIN2D
SCHEMBL18553947 0.83 DAO (0.48) DAODDOMAOAMAOBKDM4E
SCHEMBL1367535 0.81 DAO (0.66) DAODDOKDM4EHSD17B10
SCHEMBL29805139 0.78 DAO (0.42) DAODDOMAOAGRIN2DGRIN2A
SCHEMBL29804764 0.77 DAO (0.47) DAODDOMAOAGRIN2DGRIN2A
SCHEMBL866250 0.77 DAO (0.65) DAODDOKDM4EHSD17B10ALDH1A1
SCHEMBL1370450 0.76 APEX1 (0.61) KDM4ETDP1HSD17B10ALDH1A1HPGD
SCHEMBL21639550 0.75 MAOA (0.52) MAOAMAOB

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 3116/4885SPR 1906/4885

“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.