SCHEMBL13317577

SCHEMBL13317577

C/C(C=C1C(=O)NC(=O)NC1=O)=C\Nc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.40
▸ METAP1 P53582 3/20 0.40
▸ MAPT P10636 5/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ LMNA P02545 2/20 0.38
▸ HTT P42858 2/20 0.38
▸ TGM2 P21980 1/20 0.38
▸ IDO1 P14902 1/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ MEN1 O00255 2/20 0.36
▸ GAA P10253 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MAOA P21397 1/20 0.35
▸ MAOB P27338 1/20 0.35
▸ CISD1 Q9NZ45 1/20 0.35
▸ RECQL P46063 2/20 0.35
▸ USP2 O75604 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ EPHX2 P34913 1/20 0.34

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
SCHEMBL8761099 0.71 ALDH1A1 (0.52) ALDH1A1MAPTSMN1; SMN2HTTKMT2A
SCHEMBL13103220 0.71 ALDH1A1 (0.52) ALDH1A1MAPTSMN1; SMN2HTTKMT2A
SCHEMBL13317581 0.70 METAP1 (0.58) ALDH1A1METAP1MAPTSMN1; SMN2LMNA
SCHEMBL13317593 0.68 METAP1 (0.55) ALDH1A1METAP1MAPTSMN1; SMN2LMNA
SCHEMBL25690630 0.68 RECQL (0.41) ALDH1A1MAPTSMN1; SMN2HTTIDO1
SCHEMBL10412163 0.66 ALDH1A1 (0.48) ALDH1A1MAPTSMN1; SMN2HTTIDO1
SCHEMBL14839892 0.66 ALDH1A1 (0.53) ALDH1A1METAP1MAPTSMN1; SMN2LMNA
SCHEMBL28732796 0.65 ALDH1A1 (0.46) ALDH1A1MAPTSMN1; SMN2LMNAHTT
SCHEMBL4516541 0.64 NAPRT (0.54) ALDH1A1MAPTSMN1; SMN2HTTKMT2A
SCHEMBL9380483 0.64 AKR1C3 (0.50) ALDH1A1MAPTSMN1; SMN2HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7728222-B2 A photoelectric conversion device comprising an organic dye-sensitizing semiconductor fine particle thin film is prepared by using a dye having a barbituric acid structure as a partial structure and by adsorbing the dye on a semiconductor thin NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-06-01 — — US disclosed
US-7728222-B2 A photoelectric conversion device comprising an organic dye-sensitizing semiconductor fine particle thin film is prepared by using a dye having a barbituric acid structure as a partial structure and by adsorbing the dye on a semiconductor thin NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2010-06-01 — — US disclosed
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