SCHEMBL20451012

SCHEMBL20451012

c1ccc(-c2c3ccccc3c(-c3ccc(Nc4cc(-c5ccccc5)c5[nH]c6ccccc6c5c4)cc3)c3ccccc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ESR1 P03372 3/20 0.40
ESR2 Q92731 3/20 0.40
MMP2 P08253 6/20 0.39
MMP9 P14780 6/20 0.39
MMP13 P45452 6/20 0.39
MMP8 P22894 4/20 0.39
SMARCA2 P51531 1/20 0.37
SMARCA4 P51532 1/20 0.37
PBRM1 Q86U86 1/20 0.37
EGFR P00533 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HTR2B P41595 1/20 0.37
HTR5A P47898 1/20 0.37
TDO2 P48775 1/20 0.37
NQO2 P16083 1/20 0.36

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
SCHEMBL559711 0.91 MMP2 (0.47) HPGDMAPK1HTTSMN1; SMN2MMP2
SCHEMBL28137380 0.82 HPGD (0.45) HPGDMAPK1HTTSMN1; SMN2ESR1
SCHEMBL28322993 0.80 CDK4 (0.47) HPGDMAPK1HTTSMN1; SMN2ESR1
SCHEMBL2840698 0.77 PARP14 (0.47) MMP2MMP9MMP13MMP8EGFR
SCHEMBL29927316 0.77 CDK4 (0.49) HPGDMAPK1HTTSMN1; SMN2ESR1
SCHEMBL28697631 0.77 PARP14 (0.48) CDK4CCND1
SCHEMBL4451071 0.77 CDK4 (0.49) HPGDMAPK1HTTSMN1; SMN2ESR1
SCHEMBL21800967 0.76 MMP2 (0.44) ESR1ESR2MMP2MMP9MMP13
SCHEMBL28266752 0.76 MMP2 (0.41) HPGDESR1ESR2MMP2MMP9
SCHEMBL28098705 0.76 KDM4E (0.49) HPGDESR1ESR2MMP2MMP9

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
US-20180226598-A1 LIGHT-EMITTING ELEMENT, DISPLAY DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE SEMICONDUCTOR ENERGY LAB (JP) 2018-08-09 US disclosed
CN-105957971-A LIGHT-EMITTING ELEMENT, DISPLAY DEVICE, ELECTRONIC DEVICE, AND LIGHTING DEVICE 株式会社半导体能源研究所 2016-09-21 CN disclosed