SCHEMBL1712844

SCHEMBL1712844

c1ccc(-c2ccc(Nc3ccccc3Nc3ccc(-c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.52
HSD17B10 Q99714 5/20 0.52
TDP1 Q9NUW8 4/20 0.52
ALOX15 P16050 3/20 0.52
ALOX12 P18054 3/20 0.52
MAPK1 P28482 3/20 0.52
L3MBTL1 Q9Y468 3/20 0.52
TSHR P16473 2/20 0.52
PTGS1 P23219 1/20 0.52
SLC6A2 P23975 1/20 0.52
PTGS2 P35354 1/20 0.52
HTR2B P41595 1/20 0.52
MAPT P10636 6/20 0.52
KDM4E B2RXH2 3/20 0.52
GAA P10253 3/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
GLA P06280 1/20 0.52
RECQL P46063 1/20 0.52
CYP1A2 P05177 2/20 0.50

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
SCHEMBL1713049 0.97 ALDH1A1 (0.57) ALDH1A1HSD17B10TDP1ALOX15ALOX12
SCHEMBL5457659 0.86 FABP3 (0.52) ALDH1A1HSD17B10TDP1ALOX15ALOX12
SCHEMBL15549870 0.86 FABP3 (0.52) ALDH1A1HSD17B10TDP1ALOX15ALOX12
SCHEMBL29405535 0.86 FABP3 (0.52) ALDH1A1HSD17B10TDP1ALOX15ALOX12
SCHEMBL23111305 0.86 FABP3 (0.52) ALDH1A1HSD17B10TDP1ALOX15ALOX12
SCHEMBL24057710 0.86 FABP3 (0.52) ALDH1A1HSD17B10TDP1ALOX15ALOX12
SCHEMBL4428807 0.86 FABP3 (0.52) ALDH1A1HSD17B10TDP1ALOX15ALOX12
SCHEMBL5373697 0.86 MAPT (0.50) ALDH1A1HSD17B10TDP1ALOX15ALOX12
SCHEMBL5365481 0.86 FABP3 (0.52) ALDH1A1HSD17B10TDP1ALOX15ALOX12
SCHEMBL17733473 0.86 FABP3 (0.52) ALDH1A1HSD17B10TDP1ALOX15ALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3257093-B1 ELECTRONIC DEVICE CONTAINING CYCLIC LACTAMS MERCK PATENT GMBH (DE) 2021-07-07 EP disclosed
EP-3257093-B1 ELECTRONIC DEVICE CONTAINING CYCLIC LACTAMS MERCK PATENT GMBH (DE) 2021-07-07 EP disclosed
US-10784448-B2 Electroluminescent imidazo-quinoxaline carbene metal complexes UDC IRELAND LIMITED (IE) 2020-09-22 US disclosed
US-10784448-B2 Electroluminescent imidazo-quinoxaline carbene metal complexes UDC IRELAND LIMITED (IE) 2020-09-22 US disclosed
EP-3466957-A1 OLED COMPRISING AN ELECTROLUMINESCENT IMIDAZO-QUINOXALINE CARBENE METAL COMPLEXES UDC Ireland Limited (IE) 2019-04-10 EP disclosed
EP-3466957-A1 OLED COMPRISING AN ELECTROLUMINESCENT IMIDAZO-QUINOXALINE CARBENE METAL COMPLEXES UDC Ireland Limited (IE) 2019-04-10 EP disclosed
US-10249831-B2 Electronic device containing cyclic lactams MERCK PATENT GMBH (DE) 2019-04-02 US disclosed
US-10249831-B2 Electronic device containing cyclic lactams MERCK PATENT GMBH (DE) 2019-04-02 US disclosed
EP-3186264-B1 ELECTROLUMINESCENT IMIDAZO-QUINOXALINE CARBENE METAL COMPLEXES UDC IRELAND LTD (IE) 2018-11-28 EP disclosed
US-20180040832-A1 ELECTRONIC DEVICE CONTAINING CYCLIC LACTAMS MERCK PATENT GMBH (DE) 2018-02-08 US disclosed
EP-2344607-B1 ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2013-04-10 EP disclosed
EP-2344607-B1 ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2013-04-10 EP disclosed
US-20110201778-A1 Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2011-08-18 US disclosed
US-20110201778-A1 Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2011-08-18 US disclosed
US-20110201778-A1 Organic Electroluminescent Devices MERCK PATENT GMBH (DE) 2011-08-18 US disclosed
EP-2344607-A1 ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmbH (DE) 2011-07-20 EP disclosed
US-20110105778-A1 Materials for Organic Electroluminescence Devices MERCK PATENT GMBH (DE) 2011-05-05 US disclosed
US-20110105778-A1 Materials for Organic Electroluminescence Devices MERCK PATENT GMBH (DE) 2011-05-05 US disclosed
WO-2010054730-A1 ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-05-20 WO disclosed
WO-2010054730-A1 ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-05-20 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-10249831-B2 Electronic device containing cyclic lactams OXA1L, UROD, MRPL21 ALDH1A1 1536/4885HSD17B10 1397/4885TDP1 3164/4885
US-20180040832-A1 ELECTRONIC DEVICE CONTAINING CYCLIC LACTAMS OXA1L, UROD, MRPL21 ALDH1A1 1536/4885HSD17B10 1397/4885TDP1 3164/4885
US-10784448-B2 Electroluminescent imidazo-quinoxaline carbene metal complexes OCIAD1, OCIAD2, OXER1 ALDH1A1 1713/4885HSD17B10 3361/4885TDP1 4129/4885
US-20110105778-A1 Materials for Organic Electroluminescence Devices L1CAM, EPCAM, GPX1 ALDH1A1 24/4885HSD17B10 2860/4885TDP1 1129/4885
US-20110201778-A1 Organic Electroluminescent Devices L1CAM, PIEZO1, OR10J3 ALDH1A1 56/4885HSD17B10 2023/4885TDP1 1156/4885

“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.