SCHEMBL2493822

SCHEMBL2493822

COc1ccc(Cl)cc1-c1nc(Cl)nc(Cl)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
KDM4E B2RXH2 2/20 0.48
RECQL P46063 1/20 0.45
AGPAT2 O15120 8/20 0.43
HPGD P15428 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
USP2 O75604 1/20 0.43
PRNP P04156 1/20 0.43
PPARG P37231 1/20 0.43
MAPK10 P53779 1/20 0.43
NCOA2 Q15596 1/20 0.43
NCOA1 Q15788 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HSD17B10 Q99714 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.40
NPC1 O15118 1/20 0.40

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
SCHEMBL17022583 0.81 ALDH1A1 (0.54) ALDH1A1KDM4EHPGDKMT2ASMN1; SMN2
Ammonia Solution, Strong SCHEMBL4291541 0.77 RECQL (0.47) ALDH1A1KDM4ERECQLAGPAT2HPGD
SCHEMBL2499918 0.76 PIM1 (0.44) ALDH1A1KDM4EAGPAT2HPGDMEN1
SCHEMBL7699644 0.75 ALDH1A1 (0.56) ALDH1A1KDM4ERECQLAGPAT2HPGD
SCHEMBL19876397 0.74 ALDH1A1 (0.47) ALDH1A1KDM4ERECQLAGPAT2HPGD
SCHEMBL30929920 0.74 ALDH1A1 (0.54) ALDH1A1KDM4ERECQLAGPAT2HPGD
SCHEMBL19888332 0.74 ALDH1A1 (0.54) ALDH1A1KDM4ERECQLAGPAT2HPGD
SCHEMBL4057537 0.72 HSP90AA1 (0.48) ALDH1A1KDM4EMEN1KMT2ASMN1; SMN2
SCHEMBL4284941 0.72 RECQL (0.54) ALDH1A1KDM4ERECQLAGPAT2MEN1
SCHEMBL4281980 0.71 AGPAT2 (0.67) ALDH1A1KDM4ERECQLAGPAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11456424-B2 Phosphorescent host material SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2022-09-27 US disclosed
US-20210151689-A1 Organic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2021-05-20 US disclosed
US-20210151689-A1 Organic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2021-05-20 US disclosed
CN-110785421-A Organic compound, light-emitting element, light-emitting device, electronic device, and lighting device 株式会社半导体能源研究所 2020-02-11 CN disclosed
WO-2018234932-A1 ORGANIC COMPOUND, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2018-12-27 WO disclosed
EP-2040549-B1 BENZOFURO-AND BENZOTHIENOPYRYIMIDINE MODULATORS OF THE HISTAMINE H4 RECEPTOR JANSSEN PHARMACEUTICA NV (BE) 2013-10-23 EP disclosed
US-8030321-B2 Benzofuro- and benzothienopyrimidine modulators of the histamine H4 receptor JANSSEN PHARMACEUTICA, NV (BE) 2011-10-04 US disclosed
US-20090325927-A1 Benzofuro- and benzothienopyrimidine modulators of the histamine H4 receptor CHAVEZ FRANK 2009-12-31 US disclosed
US-7576092-B2 Benzofuro- and benzothienopyrimidine modulators of the histamine H4 receptor JANSSEN PHARMACEUTICA N.V. (BE) 2009-08-18 US disclosed
EP-2040549-A2 BENZOFURO-AND BENZOTHIENOPYRYIMIDINE MODULATORS OF THE HISTAMINE H4 RECEPTOR JANSSEN PHARMACEUTICA N.V. (BE) 2009-04-01 EP disclosed
US-20090076268-A1 Facile assembly of fused benzofuro-heterocycles JANSSEN PHARMACEUTICA N.V. (BE) 2009-03-19 US disclosed
US-20090076268-A1 Facile assembly of fused benzofuro-heterocycles JANSSEN PHARMACEUTICA N.V. (BE) 2009-03-19 US disclosed
US-20090076268-A1 Facile assembly of fused benzofuro-heterocycles JANSSEN PHARMACEUTICA N.V. (BE) 2009-03-19 US disclosed
WO-2009035668-A1 FACILE ASSEMBLY OF FUSED BENZOFURO-HETEROCYCLES JANSSEN PHARMACEUTICA N.V. (BE) 2009-03-19 WO disclosed
WO-2009035668-A1 FACILE ASSEMBLY OF FUSED BENZOFURO-HETEROCYCLES JANSSEN PHARMACEUTICA N.V. (BE) 2009-03-19 WO disclosed
US-20080015200-A1 Benzofuro- and benzothienopyrimidine modulators of the histamine H4 receptor JANSSEN PHARMACEUTICA, N.V. (BE) 2008-01-17 US disclosed
WO-2008008359-A2 BENZOFURO-AND BENZOTHIENOPYRYIMIDINE MODULATORS OF THE HISTAMINE H4 RECEPTOR JANSSEN PHARMACEUTICA, N.V. (BE) 2008-01-17 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 (5 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-20210151689-A1 Organic Compound, Light-Emitting Element, Light-Emitting Device, Electronic Device, and Lighting Device CDK2, CCND2, CCND1 ALDH1A1 155/4885KDM4E 2808/4885RECQL 381/4885
US-20080015200-A1 Benzofuro- and benzothienopyrimidine modulators of the histamine H4 receptor HRH4, HRH1, HRH2 ALDH1A1 2682/4885KDM4E 1224/4885RECQL 1351/4885
US-20090076268-A1 Facile assembly of fused benzofuro-heterocycles BICRA, DDC, DDT ALDH1A1 739/4885KDM4E 1620/4885RECQL 3998/4885
US-20090325927-A1 Benzofuro- and benzothienopyrimidine modulators of the histamine H4 receptor HRH4, HRH1, HRH2 ALDH1A1 2682/4885KDM4E 1224/4885RECQL 1351/4885
US-11456424-B2 Phosphorescent host material CDK2, TYMP, CCNT2 ALDH1A1 1582/4885KDM4E 3900/4885RECQL 563/4885

“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.