SCHEMBL10704182

SCHEMBL10704182

N#Cc1ccsc1N=C=O

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
HPGD P15428 1/20 0.35
BLM P54132 1/20 0.35
LMNA P02545 2/20 0.34
NPSR1 Q6W5P4 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 2/20 0.33
POLB P06746 1/20 0.33
RAB9A P51151 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.32
ALOX15 P16050 1/20 0.31
CYP1A2 P05177 1/20 0.31

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
SCHEMBL5825879 0.72 CYP3A4 (0.40) HPGDALDH1A1
SCHEMBL125480 0.71
SCHEMBL11431753 0.71
SCHEMBL3237215 0.68
SCHEMBL9388384 0.68 GAA (0.51) MEN1KMT2AHPGDBLMLMNA
SCHEMBL12006338 0.68 GABRA1 (0.47)
SCHEMBL9019517 0.68 PTGS1 (0.38) MEN1KMT2AHPGDBLMLMNA
SCHEMBL12005825 0.67 CYP3A4 (0.31)
SCHEMBL6871094 0.67 CTNNB1 (0.32)
SCHEMBL224875 0.66 ALDH1A1 (0.56) MEN1KMT2AHPGDLMNANPSR1

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-3940246-A Sublimation transfer and isocyanate fixation of amino- or hydroxy-containing dyestuffs and transfer sheets therefor CIBA-GEIGY AG (CH) 1976-02-24 US claimed
EP-0202538-B1 GROWTH PROMOTING AGENTS BAYER AG (DE) 1988-12-28 EP disclosed
US-4692461-A PLANT PROTECTION BAYER AKTIENGESELLSCHAFT (DE) 1987-09-08 US disclosed
EP-0224140-A1 Thienyl urea derivatives BAYER AG (DE) 1987-06-03 EP disclosed
US-4078886-A Sublimation transfer and diisocyanate fixation of amino- or hydroxy-containing anthraquinone dyestuffs and transfer sheets thereof CIBA-GEIGY AG (CH) 1978-03-14 US disclosed
US-3958933-A Process for the manufacture of fast dyeings on synthetic hydrophobic textile material CIBA-GEIGY CORPORATION (US) 1976-06-01 US disclosed
US-3940246-A Sublimation transfer and isocyanate fixation of amino- or hydroxy-containing dyestuffs and transfer sheets therefor CIBA-GEIGY AG (CH) 1976-02-24 US disclosed