SCHEMBL1367945

SCHEMBL1367945

O=C(c1cc2cc(F)cc(F)c2oc1=O)c1cc2cc(F)cc(F)c2oc1=O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.48
GPR35 Q9HC97 10/20 0.46
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
MAOB P27338 5/20 0.42
MAOA P21397 5/20 0.42
USP2 O75604 1/20 0.41
POLB P06746 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
ALOX12 P18054 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
HSD17B10 Q99714 1/20 0.41
NPC1 O15118 1/20 0.39
RAB9A P51151 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
SCHEMBL9069002 0.88 GPR35 (0.62) GPR35MAOBMAOAUSP2POLB
SCHEMBL1368567 0.79 MAOA (0.57) GPR35MAOBMAOAPOLBHPGD
SCHEMBL1369097 0.74 ATM (0.58) GPR35MEN1KMT2AMAOBMAOA
SCHEMBL31474888 0.71 LCK (0.55) MAPTMEN1KMT2APOLBHPGD
SCHEMBL28987437 0.71 LCK (0.55) MAPTMEN1KMT2APOLBHPGD
SCHEMBL2895230 0.70 PIM1 (0.45) MAPTGPR35KMT2A
SCHEMBL8571484 0.70 GPR35 (0.45) GPR35MEN1KMT2AMAOBMAOA
SCHEMBL1367003 0.70 GPR35 (0.79) MAPTGPR35MAOBMAOAHPGD
SCHEMBL1367802 0.70 GPR35 (0.79) MAPTGPR35MEN1KMT2AMAOB
SCHEMBL980080 0.68 MAOA (0.71) GPR35MAOBMAOAUSP2POLB

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-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 claimed
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
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 MAPT 4718/4885GPR35 4874/4885MEN1 1108/4885

“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.