SCHEMBL1697601

SCHEMBL1697601

C=Cc1ccc(-c2c3ccccc3c(-c3cccc4ccccc34)c3ccccc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.40
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 3/20 0.38
TSHR P16473 2/20 0.38
CA12 O43570 3/20 0.37
CA1 P00915 3/20 0.37
CA2 P00918 3/20 0.37
CA9 Q16790 3/20 0.37
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
TYMP P19971 1/20 0.36
GSK3B P49841 1/20 0.35
ADK P55263 1/20 0.35
MCL1 Q07820 1/20 0.35
ACMSD Q8TDX5 1/20 0.35
ENPP3 O14638 1/20 0.35
ENPP1 P22413 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
SCHEMBL669167 0.86 CA12 (0.49) MEN1KMT2AALDH1A1TSHRCA12
SCHEMBL16814673 0.84 CA12 (0.49) DHFRALDH1A1TSHRCA12CA1
SCHEMBL29751906 0.84 CA12 (0.49) DHFRALDH1A1TSHRCA12CA1
SCHEMBL4956947 0.84 ALDH1A1 (0.52) MEN1KMT2AALDH1A1TSHRHDAC8
SCHEMBL26372840 0.83 DRD1 (0.41) DHFRMEN1KMT2AALDH1A1CA12
SCHEMBL3925327 0.82 CA12 (0.51) DHFRCA12CA1CA2CA9
SCHEMBL5880675 0.81 ALDH1A1 (0.43) ALDH1A1TSHRHDAC8HDAC6ENPP1
SCHEMBL2127807 0.80 ALDH1A1 (0.46) DHFRMEN1KMT2AALDH1A1TSHR
SCHEMBL1321259 0.80 KDM4E (0.49) DHFRMEN1KMT2AALDH1A1TSHR
SCHEMBL30730878 0.80 KDM4E (0.49) DHFRMEN1KMT2AALDH1A1TSHR

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-20230320112-A1 POLYMERS, FORMULATIONS, ORGANIC OPTOELECTRONIC DEVICES, AND APPLICATIONS THEREOF Zhejiang Brilliant Optoelectronic Technology Co.,Ltd. (CN) 2023-10-05 US disclosed
US-9478762-B2 Organic electroluminescent device MERCK PATENT GMBH (DE) 2016-10-25 US disclosed
US-9410080-B2 Polymer-based organic electroluminescent device COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2016-08-09 US disclosed
US-20130277617-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2013-10-24 US disclosed
US-20130112957-A1 POLYMER-BASED ORGANIC ELECTROLUMINESCENT DEVICE COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH OR (AU) 2013-05-09 US disclosed
EP-2566932-A1 POLYMER-BASED ORGANIC ELECTROLUMINESCENT DEVICE Commonwealth Scientific and Industrial Research Organisation (AU) 2013-03-13 EP disclosed
CN-102884155-A Polymer-based organic electroluminescent device COMMW SCIENT IND RES ORG 2013-01-16 CN disclosed
WO-2012084114-A1 ORGANIC ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2012-06-28 WO disclosed
WO-2011137492-A1 POLYMER-BASED ORGANIC ELECTROLUMINESCENT DEVICE COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2011-11-10 WO disclosed