SCHEMBL12715530

SCHEMBL12715530

CCCCCCc1cc(-c2sc(-c3ccc(-c4cc(CCCCCC)c(-c5cc(CCCCCC)c(Br)s5)s4)c4nc(-c5cccs5)c(-c5cccs5)nc34)cc2CCCCCC)sc1Br

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 1/20 0.38
▸ HPGD P15428 4/20 0.33
▸ RPS6KB2 Q9UBS0 5/20 0.32
▸ ADORA2A P29274 2/20 0.32
▸ ADORA1 P30542 2/20 0.32
▸ DHFR P00374 1/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ GAPDH P04406 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ NR4A1 P22736 1/20 0.31
▸ APEX1 P27695 1/20 0.31
▸ PTPN7 P35236 1/20 0.31
▸ BLM P54132 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ CTDSP1 Q9GZU7 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31

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
SCHEMBL12715533 0.95 ADK (0.41) ADKHPGDRPS6KB2ADORA2AADORA1
SCHEMBL12715539 0.91 ADK (0.37) ADKHPGD
SCHEMBL12715477 0.85 ADK (0.37) ADKHPGDRPS6KB2ADORA2AADORA1
SCHEMBL12715522 0.85 ADK (0.38) ADKHPGDRPS6KB2ADORA2AADORA1
SCHEMBL12715534 0.82 ADK (0.36) ADKHPGD
SCHEMBL15051715 0.81 KCNH2 (0.34) DHFRMEN1KMT2AALOX15TDP1
SCHEMBL12715476 0.81 ADK (0.35) ADK
SCHEMBL12887104 0.81 MEN1 (0.31) MEN1KMT2AALOX15TDP1
SCHEMBL12887115 0.81 MEN1 (0.31) MEN1KMT2AALOX15TDP1
SCHEMBL12887123 0.81 MEN1 (0.31) MEN1KMT2AALOX15TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7923529-B2 Oligothiophene-arylene derivatives and organic thin film transistors using the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2011-04-12 — — US disclosed
US-20090256143-A1 OLIGOTHIOPHENE-ARYLENE DERIVATIVES AND ORGANIC THIN FILM TRANSISTORS USING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2009-10-15 — — US disclosed
US-7541424-B2 Oligothiophene-arylene derivatives and organic thin film transistors using the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2009-06-02 — — US disclosed
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