SCHEMBL7471897

SCHEMBL7471897

[c]1ccc(-c2ccccc2)c2sc3ccccc3c12

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TNKS O95271 2/20 0.38
TNKS2 Q9H2K2 2/20 0.38
ALOX5 P09917 1/20 0.38
GPR3 P46089 1/20 0.38
F9 P00740 1/20 0.35
MAPT P10636 2/20 0.34
MEN1 O00255 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
LIMK1 P53667 4/20 0.33
RXFP1 Q9HBX9 1/20 0.33
CDK5 Q00535 1/20 0.32
CDK5R1 Q15078 1/20 0.32
SLC9A1 P19634 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MCL1 Q07820 1/20 0.30
PARP14 Q460N5 1/20 0.30

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
SCHEMBL21295649 0.88 RAB9A (0.36) ALOX5GPR3MAPTMEN1RAB9A
SCHEMBL21295816 0.84 CYP11B1 (0.42) ALOX5MAPTMEN1RAB9AKMT2A
SCHEMBL21297031 0.78 ALOX5 (0.42) TNKSTNKS2ALOX5GPR3F9
SCHEMBL21296050 0.77 MIF (0.43) GPR3MAPTMEN1RAB9AKMT2A
SCHEMBL21295650 0.76 GPR3 (0.40) TNKSTNKS2GPR3MAPTMEN1
SCHEMBL29362337 0.73 ALOX5 (0.63) TNKSTNKS2ALOX5GPR3F9
SCHEMBL2810404 0.73 ALOX5 (0.63) TNKSTNKS2ALOX5GPR3F9
SCHEMBL25680312 0.72 GPR3 (0.43) TNKSTNKS2ALOX5GPR3F9
SCHEMBL21295781 0.71 GPR3 (0.43) TNKSTNKS2ALOX5GPR3MAPT
SCHEMBL21295750 0.71 ALOX5 (0.46) TNKSTNKS2ALOX5GPR3F9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112912372-A Cyclic azine compound, material for organic electroluminescent element, electron transport material for organic electroluminescent element, and organic electroluminescent element 东曹株式会社 2021-06-04 CN disclosed
WO-2020085319-A1 CYCLIC AZINE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ELECTRON TRANSPORT MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT 東ソー株式会社 2020-04-30 WO disclosed
WO-2019163959-A1 CYCLIC AZINE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCNET ELEMENT, AND ELECTRON-TRANSPORTING MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT 東ソー株式会社 2019-08-29 WO disclosed
EP-1244617-A1 SUBSTITUTED AMINOALKYLAMIDE DERIVATIVES AS ANTAGONISTS OF FOLLICLE STIMULATING HORMONE Ortho-McNeil Pharmaceutical, Inc. (US) 2002-10-02 EP disclosed
WO-2001047875-A1 SUBSTITUTED AMINOALKYLAMIDE DERIVATIVES AS ANTAGONISTS OF FOLLICLE STIMULATING HORMONE ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2001-07-05 WO disclosed