SCHEMBL17343522

SCHEMBL17343522

c1ccc(-c2ccc(-c3nc4cc(-c5ccccc5)ccc4c4ccc(-c5ccccc5)cc34)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DHFR P00374 1/20 0.53
▸ PIK3R1 P27986 1/20 0.45
▸ PIK3CA P42336 1/20 0.45
▸ CSNK2A2 P19784 1/20 0.44
▸ CSNK2B P67870 1/20 0.44
▸ DHODH Q02127 3/20 0.43
▸ L3MBTL1 Q9Y468 3/20 0.43
▸ GAA P10253 2/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ MKNK1 Q9BUB5 1/20 0.42
▸ ADORA2A P29274 1/20 0.42
▸ NUDT1 P36639 1/20 0.42
▸ TRIM58 Q8NG06 1/20 0.41
▸ MAP4K4 O95819 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ PDE10A Q9Y233 1/20 0.41

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
SCHEMBL17343516 1.00 DHFR (0.53) DHFRPIK3R1PIK3CACSNK2A2CSNK2B
SCHEMBL17343519 0.92 MKNK1 (0.55) DHFRPIK3CACSNK2A2CSNK2BDHODH
SCHEMBL17343535 0.89 DHFR (0.46) DHFRPIK3R1PIK3CADHODHKDM4E
SCHEMBL17343521 0.86 CYP11B1 (0.51) PIK3CACSNK2A2CSNK2BDHODHLMNA
SCHEMBL17343538 0.84 CYP11B1 (0.49) PIK3CACSNK2A2CSNK2BLMNAMEN1
SCHEMBL17343523 0.84 CSNK2A2 (0.48) PIK3CACSNK2A2CSNK2BLMNAMKNK1
SCHEMBL17343528 0.84 CSNK2A2 (0.48) PIK3CACSNK2A2CSNK2BLMNAMKNK1
SCHEMBL17343518 0.82 KDM4E (0.44) DHFRPIK3CACSNK2A2CSNK2BDHODH
SCHEMBL17343531 0.82 SRC (0.45) DHFRDHODHADORA2AALDH1A1
SCHEMBL12578121 0.82 LMNA (0.45) DHFRCSNK2A2CSNK2BDHODHL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10038147-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-07-31 — — US disclosed
US-10038147-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-07-31 — — US disclosed
US-20150364698-A1 ORGANIC LIGHT-EMITTING DEVICE INDUSTRY-ACADEMIC COOPERATION FOUNDATION GYEONGSANG NATIONAL UNIVERSITY (KR) 2015-12-17 — — US disclosed
US-20150364698-A1 ORGANIC LIGHT-EMITTING DEVICE INDUSTRY-ACADEMIC COOPERATION FOUNDATION GYEONGSANG NATIONAL UNIVERSITY (KR) 2015-12-17 — — US disclosed
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