SCHEMBL16532912

SCHEMBL16532912

N#C/C(=C\c1cc2sc(/C=C(\C#N)c3nc4ccccc4s3)cc2s1)c1nc2ccccc2s1

nearest known ligand 0.72

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.66
▸ KMT2A Q03164 4/20 0.66
▸ LMNA P02545 3/20 0.66
▸ MAPT P10636 3/20 0.66
▸ RECQL P46063 2/20 0.66
▸ KDM4E B2RXH2 1/20 0.66
▸ RAB9A P51151 3/20 0.64
▸ ALDH1A1 P00352 1/20 0.64
▸ SMN1; SMN2 Q16637 2/20 0.63
▸ HPGD P15428 1/20 0.63
▸ NFKB1 P19838 1/20 0.63
▸ NFKB2 Q00653 1/20 0.63
▸ RELA Q04206 1/20 0.63

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
SCHEMBL21036989 0.84 MEN1 (0.49) MEN1KMT2ALMNAMAPTRECQL
SCHEMBL18032712 0.84 MEN1 (0.57) MEN1KMT2ALMNAMAPTRECQL
SCHEMBL27983252 0.83 MEN1 (0.82) MEN1KMT2ALMNAMAPTRECQL
SCHEMBL14613096 0.83 MEN1 (0.69) MEN1KMT2ALMNAMAPTRECQL
SCHEMBL21234747 0.83 MEN1 (0.53) MEN1KMT2ALMNAMAPTRECQL
SCHEMBL20994201 0.82 MEN1 (0.53) MEN1KMT2ALMNAMAPTRECQL
SCHEMBL20994200 0.82 MEN1 (0.53) MEN1KMT2ALMNAMAPTRECQL
SCHEMBL21023357 0.81 MEN1 (0.66) MEN1KMT2ALMNAMAPTRECQL
SCHEMBL17131903 0.80 MEN1 (1.00) MEN1KMT2ALMNAMAPTRECQL
SCHEMBL17131948 0.80 MEN1 (1.00) MEN1KMT2ALMNAMAPTRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3036305-B1 COMPOUNDS WITH TERMINAL HETEROARYLCYANOVINYLENE GROUPS AND THEIR USE IN ORGANIC SOLAR CELLS BASF SE (DE) 2019-04-17 — — EP 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-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-20160248021-A1 COMPOUNDS WITH TERMINAL HETEROARYLCYANOVINYLENE GROUPS AND THEIR USE IN ORGANIC SOLAR CELLS BASF SE (DE) 2016-08-25 — — US 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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