SCHEMBL8103773

SCHEMBL8103773

COC(N)=S.Cc1ccc(OC(N)=S)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.47
MAPT P10636 2/20 0.47
KDM4E B2RXH2 1/20 0.47
THRB P10828 1/20 0.47
LMNA P02545 2/20 0.47
ACHE P22303 1/20 0.44
ALDH1A1 P00352 3/20 0.43
NPC1 O15118 1/20 0.43
HPGD P15428 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
WDR5 P61964 1/20 0.41
PRSS1 P07477 1/20 0.40
ACR P10323 1/20 0.40
TEAD4 Q15561 1/20 0.39
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 2/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL11485695 0.94 LMNA (0.52) GAAMAPTKDM4ETHRBLMNA
SCHEMBL6310745 0.81 CA4 (0.42) GAAMAPTALDH1A1NPC1RAB9A
SCHEMBL7306942 0.80 CA1 (0.52) GAAACHEALDH1A1HPGDPRSS1
SCHEMBL28806666 0.79 CA4 (0.41) GAAMAPTALDH1A1NPC1RAB9A
SCHEMBL28674679 0.79 CA4 (0.41) GAAMAPTALDH1A1NPC1RAB9A
SCHEMBL8103713 0.79 SMN1; SMN2 (0.50) KDM4ELMNAALDH1A1NPC1HPGD
SCHEMBL8101869 0.77 KIF11 (0.53) LMNAALDH1A1PRSS1ACRKMT2A
SCHEMBL5655838 0.75 LMNA (0.56) GAAMAPTKDM4ETHRBLMNA
SCHEMBL1401005 0.73 LMNA (0.54) GAAMAPTKDM4ETHRBLMNA
SCHEMBL16639671 0.72 ACHE (0.65) GAAMAPTKDM4ETHRBLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6121476-A Process for preparing dithiocarbonimide derivatives SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-09-19 US disclosed
EP-0811612-B1 Process for preparing dithiocarbonimide derivatives SUMITOMO CHEMICAL CO (JP) 1999-03-03 EP disclosed
EP-0811612-A1 Process for preparing dithiocarbonimide derivatives SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1997-12-10 EP disclosed