SCHEMBL12725117

SCHEMBL12725117

CN1C(=O)C2=C(c3ccc(-c4cccs4)s3)N(C)C(=O)C2=C1c1ccc(-c2cccs2)s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 4/20 0.50
▸ ALDH1A1 P00352 5/20 0.45
▸ KDM4E B2RXH2 5/20 0.45
▸ GAA P10253 3/20 0.45
▸ L3MBTL1 Q9Y468 3/20 0.45
▸ LMNA P02545 2/20 0.45
▸ GLA P06280 2/20 0.45
▸ MAPT P10636 2/20 0.45
▸ NPC1 O15118 3/20 0.43
▸ RAB9A P51151 3/20 0.43
▸ MEN1 O00255 2/20 0.41
▸ POLB P06746 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ CASP1 P29466 2/20 0.41
▸ CASP7 P55210 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ NFKB1 P19838 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
SCHEMBL12725123 1.00 DPP4 (0.50) DPP4ALDH1A1KDM4EGAAL3MBTL1
SCHEMBL15932566 0.97 DPP4 (0.46) DPP4ALDH1A1KDM4EGAAL3MBTL1
SCHEMBL15932568 0.97 DPP4 (0.46) DPP4ALDH1A1KDM4EGAAL3MBTL1
SCHEMBL15932569 0.97 DPP4 (0.46) DPP4ALDH1A1KDM4EGAAL3MBTL1
SCHEMBL12725115 0.88 PRKCA (0.38) DPP4ALDH1A1KDM4EL3MBTL1MAPT
SCHEMBL20747285 0.85 DPP4 (0.40) DPP4ALDH1A1KDM4EGAAL3MBTL1
SCHEMBL15249512 0.85 APP (0.44) DPP4ALDH1A1KDM4EGAAL3MBTL1
SCHEMBL15249511 0.85 DPP4 (0.36) DPP4ALDH1A1KDM4EGAAL3MBTL1
SCHEMBL14757456 0.84 PRKDC (0.41) DPP4ALDH1A1KDM4EGAAL3MBTL1
SCHEMBL2607455 0.83 DPP4 (0.41) DPP4ALDH1A1KDM4EGAAL3MBTL1

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
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
US-9214258-B2 Semiconductor composites comprising carbon nanotubes and diketopyrrolopyrrole-thiophene based copolymers XEROX CORPORATION (US) 2015-12-15 — — US disclosed
US-20140158946-A1 SEMICONDUCTOR COMPOSITES COMPRISING CARBON NANOTUBES AND DIKETOPYRROLOPYRROLE-THIOPHENE BASED COPOLYMERS XEROX CORPORATION (US) 2014-06-12 — — US disclosed
US-7932344-B2 Diketopyrrolopyrrole-based polymers XEROX CORPORATION (US) 2011-04-26 — — US disclosed
US-7910684-B2 Diketopyrrolopyrrole-based derivatives for thin film transistors XEROX CORPORATION (US) 2011-03-22 — — US disclosed
US-20090065878-A1 DIKETOPYRROLOPYRROLE-BASED DERIVATIVES FOR THIN FILM TRANSISTORS XEROX CORPORATION 2009-03-12 — — US disclosed
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