SCHEMBL802805

SCHEMBL802805

c1ccc2c(c1)-c1cc3c(cc1C21c2ccccc2-c2cc4c(cc21)[nH]c1ccccc14)[nH]c1ccccc13

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.55
ALDH1A1 P00352 2/20 0.47
HSD17B10 Q99714 2/20 0.47
GPR3 P46089 1/20 0.47
PGR P06401 1/20 0.44
KIF11 P52732 11/20 0.44
KDM4E B2RXH2 2/20 0.41
MAPT P10636 2/20 0.41
ATM Q13315 1/20 0.41
MEN1 O00255 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 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
SCHEMBL30487042 1.00 AHR (0.55) AHRALDH1A1HSD17B10GPR3PGR
SCHEMBL802247 1.00 AHR (0.55) AHRALDH1A1HSD17B10GPR3PGR
SCHEMBL20199486 0.98 AHR (0.53) AHRALDH1A1HSD17B10GPR3PGR
SCHEMBL29520226 0.93 AHR (0.55) AHRALDH1A1HSD17B10GPR3PGR
SCHEMBL2603647 0.93 AHR (0.55) AHRALDH1A1HSD17B10GPR3PGR
SCHEMBL2603653 0.93 AHR (0.55) AHRALDH1A1HSD17B10GPR3PGR
SCHEMBL21217586 0.93 AHR (0.47) AHRALDH1A1HSD17B10GPR3PGR
SCHEMBL20199810 0.92 AHR (0.53) AHRALDH1A1HSD17B10GPR3PGR
SCHEMBL20203632 0.92 AHR (0.57) AHRALDH1A1HSD17B10GPR3PGR
SCHEMBL17381095 0.91 AHR (0.46) AHRALDH1A1HSD17B10GPR3PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10847727-B2 Compositions for electronic devices MERCK PATENT GMBH (DE) 2020-11-24 US disclosed
US-9818948-B2 Carbazole derivatives for organic electroluminescence devices MERCK PATENT GMBH (DE) 2017-11-14 US disclosed
US-9818948-B2 Carbazole derivatives for organic electroluminescence devices MERCK PATENT GMBH (DE) 2017-11-14 US disclosed
US-20170141328-A1 COMPOSITIONS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-05-18 US disclosed
EP-2758372-B1 CARBAZOLE DERIVATIVES FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-05-17 EP disclosed
US-9537105-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2017-01-03 US disclosed
US-20150318478-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-11-05 US disclosed
US-20150318478-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-11-05 US disclosed
US-9126970-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-09-08 US disclosed
US-9126970-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-09-08 US disclosed
US-20140225046-A1 CARBAZOLE DERIVATIVES FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2014-08-14 US disclosed
US-20140225046-A1 CARBAZOLE DERIVATIVES FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2014-08-14 US disclosed
WO-2013041176-A1 CARBAZOLE DERIVATIVES FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2013-03-28 WO disclosed
US-20120068170-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-03-22 US disclosed
US-20120068170-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-03-22 US disclosed
WO-2010136109-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-12-02 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 (4 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-20150318478-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SLCO2B1, SLCO1B3, SLCO4C1 AHR 1011/4885ALDH1A1 1226/4885HSD17B10 1999/4885
US-20170141328-A1 COMPOSITIONS FOR ELECTRONIC DEVICES EFNA1, EPHA6, EPHB6 AHR 1411/4885ALDH1A1 1174/4885HSD17B10 3017/4885
US-10847727-B2 Compositions for electronic devices EFNA1, EPHA6, EPHB6 AHR 1411/4885ALDH1A1 1174/4885HSD17B10 3017/4885
US-20120068170-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES SLCO2B1, SLCO1B3, SLCO4C1 AHR 1011/4885ALDH1A1 1226/4885HSD17B10 1999/4885

“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.