SCHEMBL1711024

SCHEMBL1711024

O=C(c1ccccc1)c1cc2c(ccc3ccccc32)oc1=O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.76
KDM4E B2RXH2 10/20 0.76
GLA P06280 7/20 0.76
GAA P10253 5/20 0.76
HPGD P15428 5/20 0.76
MAOB P27338 3/20 0.70
PPARG P37231 1/20 0.69
LMNA P02545 1/20 0.68
MAPT P10636 2/20 0.61
TDP1 Q9NUW8 2/20 0.61
MAOA P21397 2/20 0.60
MIF P14174 1/20 0.60
GPR55 Q9Y2T6 1/20 0.58
HSD17B10 Q99714 2/20 0.57
CASP1 P29466 1/20 0.57
CASP7 P55210 1/20 0.57
TSHR P16473 1/20 0.56
HTT P42858 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
NPC1 O15118 2/20 0.55

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
SCHEMBL2510780 0.89 ALDH1A1 (0.65) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL1710937 0.89 ALDH1A1 (0.65) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL1710778 0.89 MAOB (0.67) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL2510193 0.89 ALDH1A1 (0.65) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL2508919 0.87 ALDH1A1 (0.62) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL2505053 0.87 ALDH1A1 (0.62) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL2508806 0.87 MAOB (0.64) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL1710766 0.87 ALDH1A1 (0.62) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL1711145 0.87 ALDH1A1 (0.62) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL2807607 0.87 ALDH1A1 (1.00) ALDH1A1KDM4EGLAGAAHPGD

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022044759-A1 COMPOSITION CONTAINING SEMICONDUCTOR NANOPARTICLES, COLOR FILTER, AND IMAGE DISPLAY DEVICE 三菱ケミカル株式会社 2022-03-03 WO disclosed
US-20200270216-A1 COMPOSITIONS AND METHODS FOR INHIBITING N-SMASE2 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-08-27 US disclosed
EP-2695930-B1 POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, POLARIZED LIGHT-EMITTING COATING MATERIAL, NOVEL NAPHTHOLACTAM DERIVATIVE, NOVEL COUMARIN DERIVATIVE, NOVEL NILE RED DERIVATIVE, AND NOVEL ANTHRACENE DERIVATIVE DAINIPPON INK & CHEMICALS (JP) 2019-09-11 EP disclosed
WO-2019055832-A1 COMPOSITIONS AND METHODS FOR INHIBITING N-SMASE2 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2019-03-21 WO disclosed
US-9951034-B2 3-ketocoumarines for LED photocuring IGM RESINS ITALIA S.R.L. (IT) 2018-04-24 US disclosed
US-9475991-B2 Polymerizable liquid crystal composition, polarized light-emitting coating material, novel naphtholactam derivative novel coumarin derivative, novel nile red derivative, and novel anthracene derivative ADEKA CORPORATION (JP) 2016-10-25 US disclosed
US-9475991-B2 Polymerizable liquid crystal composition, polarized light-emitting coating material, novel naphtholactam derivative novel coumarin derivative, novel nile red derivative, and novel anthracene derivative ADEKA CORPORATION (JP) 2016-10-25 US disclosed
EP-2344462-B1 PYRIMIDINE DERIVATIVES AND THEIR PHARMACEUTICAL USE UNIV DUNDEE (GB) 2016-05-18 EP disclosed
US-20130334461-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, POLARIZED LIGHT-EMITTING COATING MATERIAL, NOVEL NAPHTHOLACTAM DERIVATIVE NOVEL COUMARIN DERIVATIVE, NOVEL NILE RED DERIVATIVE, AND NOVEL ANTHRACENE DERIVATIVE ADEKA CORPORATION (JP) 2013-12-19 US disclosed
US-20130334461-A1 POLYMERIZABLE LIQUID CRYSTAL COMPOSITION, POLARIZED LIGHT-EMITTING COATING MATERIAL, NOVEL NAPHTHOLACTAM DERIVATIVE NOVEL COUMARIN DERIVATIVE, NOVEL NILE RED DERIVATIVE, AND NOVEL ANTHRACENE DERIVATIVE ADEKA CORPORATION (JP) 2013-12-19 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
US-20110245282-A1 Compounds University Court of the University of Dundee University Court of the University of St. Andrews 2011-10-06 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
WO-2010038043-A1 PYRIMIDE DERIVATIVES AND THEIR PHARMACEUTICAL USE THE UNIVERSITY COURT OF THE UNIVERSITY OF DUNDEE (GB) 2010-04-08 WO disclosed
US-7514406-B2 Methods for inhibiting deacetylase activity FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2009-04-07 US disclosed
US-7514406-B2 Methods for inhibiting deacetylase activity FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2009-04-07 US disclosed
WO-2003046207-A2 METHODS FOR INHIBITING DEACETYLASE ACTIVITY FRED HUTCHINSON CANCER RESEARCH CENTER (US) 2003-06-05 WO disclosed
EP-0276016-A2 Photopolymerizable composition Nippon Paint Co., Ltd. (JP) 1988-07-27 EP 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 ALDH1A1 1954/4885KDM4E 3359/4885GLA 1050/4885
US-20200270216-A1 COMPOSITIONS AND METHODS FOR INHIBITING N-SMASE2 SMN1; SMN2, PSEN2, SMPD2 ALDH1A1 3977/4885KDM4E 3643/4885GLA 157/4885

“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.