SCHEMBL30969418

SCHEMBL30969418

Clc1cc(-c2ccccc2)cc(-c2nc(-c3ccccc3)nc(-c3ccc4c(c3)oc3ccccc34)n2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 2/20 0.50
MEN1 O00255 4/20 0.39
MAPT P10636 4/20 0.39
KMT2A Q03164 4/20 0.39
ALDH1A1 P00352 3/20 0.39
HPGD P15428 3/20 0.39
KDM4E B2RXH2 1/20 0.39
MMP12 P39900 1/20 0.39
MMP13 P45452 1/20 0.39
NR1I3 Q14994 1/20 0.39
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB1 P18505 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38

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
SCHEMBL29927111 0.95 AHR (0.48) AHRMEN1MAPTKMT2AALDH1A1
SCHEMBL20991443 0.93 AHR (0.45) AHRMEN1MAPTKMT2AALDH1A1
SCHEMBL20991439 0.93 AHR (0.45) AHRMEN1MAPTKMT2AALDH1A1
SCHEMBL21029374 0.93 AHR (0.45) AHRMEN1MAPTKMT2AALDH1A1
SCHEMBL21029435 0.93 AHR (0.45) AHRMEN1MAPTKMT2AALDH1A1
SCHEMBL23319183 0.92 MMP12 (0.44) AHRMEN1MAPTKMT2AALDH1A1
SCHEMBL21029049 0.92 MMP12 (0.44) AHRMEN1MAPTKMT2AALDH1A1
SCHEMBL20991445 0.92 MMP12 (0.44) AHRMEN1MAPTKMT2AALDH1A1
SCHEMBL21108868 0.92 MMP12 (0.44) AHRMEN1MAPTKMT2AALDH1A1
SCHEMBL21108869 0.92 MMP12 (0.44) AHRMEN1MAPTKMT2AALDH1A1

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
WO-2024144206-A1 COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 솔루스첨단소재 주식회사 2024-07-04 WO disclosed
WO-2024144190-A1 COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 솔루스첨단소재 주식회사 2024-07-04 WO disclosed