SCHEMBL21390580

SCHEMBL21390580

C=Cc1ccc2c3ccc(-c4cccc(-c5cccc(-c6nc(-c7ccccc7)nc(-c7ccccc7)n6)c5)c4)cc3c3ccccc3c2c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.37
KMT2A Q03164 6/20 0.37
ALDH1A1 P00352 5/20 0.37
MAPT P10636 3/20 0.37
HPGD P15428 3/20 0.37
LMNA P02545 3/20 0.36
KDM4E B2RXH2 2/20 0.36
ATM Q13315 1/20 0.36
GLA P06280 1/20 0.36
PTGS2 P35354 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NTSR1 P30989 1/20 0.34
CYP1A2 P05177 3/20 0.33
CYP3A4 P08684 3/20 0.33
CYP2C9 P11712 3/20 0.33
CYP2D6 P10635 2/20 0.33
CYP2C19 P33261 2/20 0.33
HSD17B10 Q99714 2/20 0.33
CLK4 Q9HAZ1 2/20 0.33
USP2 O75604 1/20 0.33

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
SCHEMBL21390343 0.97 PTGS2 (0.38) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL21390522 0.96 MEN1 (0.40) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL21390340 0.91 MEN1 (0.33) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL21390337 0.91 MEN1 (0.44) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL21390520 0.87 MEN1 (0.45) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL29500540 0.86 MEN1 (0.47) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL29776774 0.86 MEN1 (0.47) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL29712313 0.86 MEN1 (0.47) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL16641373 0.86 MEN1 (0.47) MEN1KMT2AALDH1A1MAPTHPGD
SCHEMBL16566413 0.86 MEN1 (0.47) MEN1KMT2AALDH1A1MAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3547384-A1 HIGH POLYMER, MIXTURE CONTAINING SAME, COMPOSITION, ORGANIC ELECTRONIC COMPONENT, AND MONOMER FOR POLYMERIZATION Guangzhou Chinaray Optoelectronic Materials Ltd. (CN) 2019-10-02 EP disclosed
US-20190292309-A1 HIGH POLYMER, MIXTURE CONTAINING SAME, COMPOSITION, ORGANIC ELECTRONIC COMPONENT, AND MONOMER FOR POLYMERIZATION GUANGZHOU CHINARAY OPTOELECTRONIC MATERIALS LTD. (CN) 2019-09-26 US disclosed