SCHEMBL9054686

SCHEMBL9054686

CN1C(=C2SC(=S)N(CCC(=O)O)C2=O)Sc2ccccc21

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 11/20 0.60
▸ KMT2A Q03164 11/20 0.60
▸ APEX1 P27695 2/20 0.58
▸ DUSP3 P51452 2/20 0.55
▸ MAPT P10636 2/20 0.55
▸ CTDSP1 Q9GZU7 2/20 0.55
▸ MCL1 Q07820 1/20 0.55
▸ POLB P06746 5/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ LMNA P02545 1/20 0.54
▸ PTPN7 P35236 1/20 0.54
▸ CACNA1B Q00975 1/20 0.54
▸ APBA1 Q02410 1/20 0.54
▸ PTPN12 Q05209 1/20 0.54
▸ PTPN22 Q9Y2R2 1/20 0.54
▸ MMP13 P45452 2/20 0.52
▸ CISD1 Q9NZ45 2/20 0.51
▸ MAOA P21397 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50

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
SCHEMBL9054683 1.00 MEN1 (0.60) MEN1KMT2AAPEX1DUSP3MAPT
SCHEMBL8606929 0.89 MEN1 (0.61) MEN1KMT2AAPEX1DUSP3MAPT
SCHEMBL8606927 0.89 MEN1 (0.61) MEN1KMT2AAPEX1DUSP3MAPT
SCHEMBL10661708 0.89 MEN1 (0.76) MEN1KMT2AAPEX1DUSP3MAPT
SCHEMBL17069352 0.87 KMT2A (0.62) MEN1KMT2ADUSP3MAPTCTDSP1
SCHEMBL2333246 0.84 MEN1 (0.81) MEN1KMT2AMAPTPOLBSMN1; SMN2
SCHEMBL15995453 0.84 MEN1 (0.81) MEN1KMT2AMAPTPOLBSMN1; SMN2
SCHEMBL2333243 0.84 MEN1 (0.81) MEN1KMT2AMAPTPOLBSMN1; SMN2
SCHEMBL10036086 0.84 MEN1 (0.72) MEN1KMT2AAPEX1DUSP3MAPT
SCHEMBL9651467 0.84 MEN1 (0.58) MEN1KMT2AAPEX1MAPTCTDSP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0487010-B1 Improved sensitization of tabular grains with a zeromethine dye and a tetraazaindene DU PONT (US) 1996-03-20 — — EP claimed
EP-0487010-A1 Improved sensitization of tabular grains with a zeromethine dye and a tetraazaindene E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-05-27 — — EP claimed
EP-0487010-B1 Improved sensitization of tabular grains with a zeromethine dye and a tetraazaindene DU PONT (US) 1996-03-20 — — EP disclosed
EP-0487010-A1 Improved sensitization of tabular grains with a zeromethine dye and a tetraazaindene E.I. DU PONT DE NEMOURS AND COMPANY (US) 1992-05-27 — — EP disclosed
US-5108887-A Zeromethine merocyanine dyes as J-aggregating spectral sensitizers for tabular emulsions E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-04-28 — — US disclosed
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