SCHEMBL16532879

SCHEMBL16532879

O=Cc1ccc(-c2ccc(-c3ccc(C=O)s3)c3nsnc23)s1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2E1 P05181 1/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ CYP2A6 P11509 1/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ CYP2B6 P20813 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ DPP4 P27487 1/20 0.43
▸ PRF1 P14222 1/20 0.40
▸ KDM4E B2RXH2 3/20 0.39
▸ MAPT P10636 3/20 0.39
▸ HPGD P15428 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ CHRM2 P08172 1/20 0.38
▸ CHRM4 P08173 1/20 0.38
▸ CHRM5 P08912 1/20 0.38
▸ CHRM1 P11229 1/20 0.38
▸ CHRM3 P20309 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
SCHEMBL16533128 0.96 DPP4 (0.49) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6
SCHEMBL28909433 0.91 CYP2E1 (0.39) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6
SCHEMBL2028227 0.88 DPP4 (0.60) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6
SCHEMBL18032738 0.87 CYP2E1 (0.36) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6
SCHEMBL18032739 0.84 DPP4 (0.39) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6
SCHEMBL20718439 0.84 KDM4E (0.43) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6
SCHEMBL19954113 0.81 DPP4 (0.45) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6
SCHEMBL28701262 0.81 APP (0.62) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6
SCHEMBL16432665 0.80 APP (0.48) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6
SCHEMBL19931537 0.77 DPP4 (0.38) CYP2E1CYP3A4CYP2A6CYP2C9CYP2B6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015142173-A1 SMALL AZOMETHINE MOLECULES AND THEIR USE IN PHOTOVOLTAIC DEVICES TECHNISCHE UNIVERSITEIT DELFT (NL) 2015-09-24 — — WO claimed
CN-121824875-A D-A structure type heterogeneous catalyst COFBTTC-PYPreparation method and application thereof 山东省海洋科学研究院(青岛国家海洋科学研究中心) 2026-04-10 — — CN disclosed
CN-121574125-A Selenium-containing aggregation-induced emission organic small molecular compound and application thereof in radioactive photodynamic therapy 大连理工大学 2026-02-27 — — CN disclosed
US-9917260-B2 Compounds with terminal heteroarylcyanovinylene groups and their use in organic solar cells BASF SE (DE) 2018-03-13 — — US disclosed
US-20160248021-A1 COMPOUNDS WITH TERMINAL HETEROARYLCYANOVINYLENE GROUPS AND THEIR USE IN ORGANIC SOLAR CELLS BASF SE (DE) 2016-08-25 — — US disclosed
WO-2015142173-A1 SMALL AZOMETHINE MOLECULES AND THEIR USE IN PHOTOVOLTAIC DEVICES TECHNISCHE UNIVERSITEIT DELFT (NL) 2015-09-24 — — WO disclosed
WO-2015024848-A1 COMPOUNDS WITH TERMINAL HETEROARYLCYANOVINYLENE GROUPS AND THEIR USE IN ORGANIC SOLAR CELLS BASF SE (DE) 2015-02-26 — — WO disclosed
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