SCHEMBL1367940

SCHEMBL1367940

COc1ccc(C=CC(=O)c2cc3cc(Cl)ccc3sc2=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 7/20 0.58
MAOB P27338 5/20 0.58
MAOA P21397 1/20 0.57
MAPT P10636 7/20 0.53
ALDH1A1 P00352 4/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
ACHE P22303 1/20 0.52
BACE1 P56817 1/20 0.52
MAPK1 P28482 4/20 0.51
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
CYP3A4 P08684 3/20 0.51
LMNA P02545 3/20 0.51
TP53 P04637 2/20 0.51
CYP2C19 P33261 2/20 0.51
HPGD P15428 2/20 0.51
ALOX15 P16050 2/20 0.51
HSD17B10 Q99714 2/20 0.51
CYP2D6 P10635 1/20 0.51
PKM P14618 1/20 0.51

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
SCHEMBL1369244 1.00 ABCG2 (0.58) ABCG2MAOBMAOAMAPTALDH1A1
SCHEMBL1367939 1.00 ABCG2 (0.58) ABCG2MAOBMAOAMAPTALDH1A1
SCHEMBL1368611 0.91 MAOB (0.53) ABCG2MAOBMAOAMAPTMAPK1
SCHEMBL1366805 0.91 MAOB (0.53) ABCG2MAOBMAOAMAPTMAPK1
SCHEMBL1366807 0.91 MAOB (0.53) ABCG2MAOBMAOAMAPTMAPK1
SCHEMBL1367949 0.88 ABCG2 (0.62) ABCG2MAOBMAOAMAPTALDH1A1
SCHEMBL1369587 0.88 ABCG2 (0.62) ABCG2MAOBMAOAMAPTALDH1A1
SCHEMBL1367951 0.88 ABCG2 (0.62) ABCG2MAOBMAOAMAPTALDH1A1
SCHEMBL1366394 0.87 GSK3B (0.53) ABCG2MAOBMAOAMAPTALDH1A1
SCHEMBL1367654 0.87 GSK3B (0.53) ABCG2MAOBMAOAMAPTALDH1A1

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 4 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

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 ABCG2 57/4885MAOB 2929/4885MAOA 3570/4885

“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.