SCHEMBL8099701

SCHEMBL8099701

COC(=O)c1sccc1N=C=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.47
NPC1 O15118 1/20 0.46
MEN1 O00255 2/20 0.45
CYP1A2 P05177 1/20 0.45
HPGD P15428 3/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
POLB P06746 3/20 0.43
HTT P42858 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
KDM4E B2RXH2 3/20 0.42
NPSR1 Q6W5P4 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPK10 P53779 2/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
PKM P14618 1/20 0.41
ATM Q13315 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 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
Water SCHEMBL27477225 0.98 KMT2A (0.46) KMT2ANPC1MEN1CYP1A2HPGD
SCHEMBL2919829 0.85 NPC1 (0.49) KMT2ANPC1MEN1CYP1A2HPGD
SCHEMBL13140451 0.79 NPC1 (0.53) KMT2ANPC1MEN1CYP1A2HPGD
SCHEMBL12166529 0.79 KMT2A (0.50) KMT2ANPC1MEN1CYP1A2HPGD
SCHEMBL16413176 0.79 PTPN2 (0.41) KMT2ANPC1MEN1HPGDL3MBTL1
SCHEMBL26981928 0.75 KMT2A (0.46) KMT2ANPC1MEN1CYP1A2HPGD
SCHEMBL1847138 0.75 KMT2A (0.48) KMT2ANPC1MEN1CYP1A2HPGD
SCHEMBL1847139 0.75 KMT2A (0.48) KMT2ANPC1MEN1CYP1A2HPGD
SCHEMBL1939080 0.74 NPC1 (0.48) KMT2ANPC1MEN1CYP1A2HPGD
SCHEMBL1939079 0.74 NPC1 (0.48) KMT2ANPC1MEN1CYP1A2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240154124-A1 NEGATIVE ELECTRODE PLATE AND LITHIUM-ION BATTERY COMPRISING SAME ZHUHAI COSMX BATTERY CO., LTD. (CN) 2024-05-09 US claimed
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
US-6096895-A Heterocyclic dihydrazole compounds and their use for controlling fungal plant diseases E. I. DU PONT DE NEMOURS AND COMPANY (US) 2000-08-01 US disclosed
EP-0825992-A1 FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1998-03-04 EP disclosed
WO-1996036633-A1 FUNGICIDAL CYCLIC AMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1996-11-21 WO disclosed
EP-0202538-B1 GROWTH PROMOTING AGENTS BAYER AG (DE) 1988-12-28 EP disclosed
EP-0202538-A1 Growth promoting agents BAYER AG (DE) 1986-11-26 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