SCHEMBL1710778

SCHEMBL1710778

Cc1ccc(C(=O)c2cc3c(ccc4ccccc43)oc2=O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.67
PPARG P37231 1/20 0.67
ALDH1A1 P00352 12/20 0.65
KDM4E B2RXH2 11/20 0.65
GLA P06280 7/20 0.65
GAA P10253 7/20 0.65
HPGD P15428 6/20 0.65
LMNA P02545 1/20 0.62
MAPT P10636 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
HSD17B10 Q99714 3/20 0.56
CASP1 P29466 2/20 0.56
CASP7 P55210 2/20 0.56
USP2 O75604 1/20 0.54
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
HIF1A Q16665 1/20 0.52
CYP1A2 P05177 1/20 0.50
GPR55 Q9Y2T6 1/20 0.50
RUNX1 Q01196 1/20 0.49

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
SCHEMBL1711024 0.89 ALDH1A1 (0.76) MAOBPPARGALDH1A1KDM4EGLA
SCHEMBL2508806 0.88 MAOB (0.64) MAOBPPARGALDH1A1KDM4EGLA
SCHEMBL2510193 0.87 ALDH1A1 (0.65) MAOBPPARGALDH1A1KDM4EGLA
SCHEMBL1710937 0.87 ALDH1A1 (0.65) MAOBPPARGALDH1A1KDM4EGLA
SCHEMBL2510780 0.87 ALDH1A1 (0.65) MAOBPPARGALDH1A1KDM4EGLA
SCHEMBL17083907 0.86 PPARG (0.70) MAOBPPARGALDH1A1KDM4EGLA
SCHEMBL1711220 0.86 PPARG (0.73) MAOBPPARGALDH1A1KDM4EGLA
SCHEMBL28014855 0.82 ALDH1A1 (0.67) MAOBPPARGALDH1A1KDM4EGAA
SCHEMBL28471066 0.81 PPARG (1.00) MAOBPPARGALDH1A1KDM4EGLA
SCHEMBL10702057 0.81 MAOB (1.00) MAOBPPARGALDH1A1KDM4EGLA

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9951034-B2 3-ketocoumarines for LED photocuring IGM RESINS ITALIA S.R.L. (IT) 2018-04-24 US disclosed
US-9951034-B2 3-ketocoumarines for LED photocuring IGM RESINS ITALIA S.R.L. (IT) 2018-04-24 US disclosed
EP-2344462-B1 PYRIMIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE UNIV DUNDEE (GB) 2016-05-18 EP disclosed
US-20150259316-A1 3-KETOCOUMARINES FOR LED PHOTOCURING ELIOS S.R.L. (IT) 2015-09-17 US disclosed
US-20150259316-A1 3-KETOCOUMARINES FOR LED PHOTOCURING ELIOS S.R.L. (IT) 2015-09-17 US disclosed
US-8563557-B2 Pyrimidine derivatives and their pharmaceutical use UNIVERSITY COURT OF THE UNIVERSITY OF DUNDEE (GB) 2013-10-22 US disclosed
US-20110245282-A1 Compounds University Court of the University of Dundee University Court of the University of St. Andrews 2011-10-06 US disclosed
EP-2344462-A1 PYRIMIDE DERIVATIVES AND THEIR PHARMACEUTICAL USE The University Court of the University of Dundee (GB) 2011-07-20 EP disclosed
WO-2010038043-A1 PYRIMIDE DERIVATIVES AND THEIR PHARMACEUTICAL USE THE UNIVERSITY COURT OF THE UNIVERSITY OF DUNDEE (GB) 2010-04-08 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 (2 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-20110245282-A1 Compounds NAT1, AR, ARSA MAOB 926/4885PPARG 354/4885ALDH1A1 1954/4885
US-20150259316-A1 3-KETOCOUMARINES FOR LED PHOTOCURING KDM3A, KMO, HCCS MAOB 1444/4885PPARG 3436/4885ALDH1A1 429/4885

“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.