SCHEMBL8977667

SCHEMBL8977667

COC(=S)Nc1cccnc1.NC(O)=S

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.55
HPGD P15428 1/20 0.55
KDM4E B2RXH2 6/20 0.52
RAB9A P51151 2/20 0.50
NPC1 O15118 1/20 0.50
PKM P14618 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.49
LMNA P02545 2/20 0.49
HTT P42858 1/20 0.49
KMT2A Q03164 1/20 0.48

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
SCHEMBL9383012 0.83 PKM (0.56) ALDH1A1HPGDKDM4ERAB9ANPC1
Methane SCHEMBL11836732 0.81 PKM (0.54) ALDH1A1HPGDKDM4ERAB9ANPC1
SCHEMBL6963209 0.81 ALDH1A1 (0.59) ALDH1A1HPGDRAB9ANPC1SMN1; SMN2
SCHEMBL4399387 0.80 SMN1; SMN2 (0.46) ALDH1A1HPGDKDM4EPKMSMN1; SMN2
SCHEMBL29972743 0.79 ALDH1A1 (0.57) ALDH1A1HPGDKDM4ERAB9ANPC1
SCHEMBL525722 0.79 ALDH1A1 (0.57) ALDH1A1HPGDKDM4ERAB9ANPC1
SCHEMBL14715013 0.77 LMNA (0.43) ALDH1A1HPGDKDM4ERAB9ANPC1
SCHEMBL805874 0.75 LMNA (0.57) ALDH1A1HPGDKDM4ERAB9ANPC1
SCHEMBL8862853 0.75 BAZ2B (0.46) ALDH1A1KDM4ERAB9ANPC1SMN1; SMN2
SCHEMBL15510403 0.75 MAPT (0.74) ALDH1A1HPGDKDM4EPKMSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5510344-A Acrylate fungicides SCHERING AGROCHEMICALS LIMITED (GB) 1996-04-23 US disclosed
EP-0378308-B1 Acrylate fungicides AGREVO UK LTD (GB) 1996-04-10 EP disclosed
US-5332752-A Acrylate fungicides SCHERING AGROCHEMICALS LIMITED (GB) 1994-07-26 US disclosed
EP-0378308-A1 Acrylate fungicides AgrEvo UK Limited (GB) 1990-07-18 EP disclosed