SCHEMBL9876372

SCHEMBL9876372

CN(C)S(=O)(=O)n1cc(-c2ccccc2)nc1C=NO

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.43
KDM4E B2RXH2 7/20 0.40
ALDH1A1 P00352 6/20 0.40
MAPT P10636 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.36
HPGD P15428 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
GFER P55789 1/20 0.36
MEN1 O00255 5/20 0.35
KMT2A Q03164 5/20 0.35
TAAR1 Q96RJ0 1/20 0.35
HSD17B10 Q99714 1/20 0.34
TLR9 Q9NR96 1/20 0.34
SCD O00767 1/20 0.34
DHODH Q02127 1/20 0.33
HCRTR1 O43613 1/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL9876370 1.00 TSHR (0.43) TSHRKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL7513475 0.83 TSHR (0.47) TSHRKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL9876058 0.77 CA12 (0.32)
SCHEMBL9876172 0.77 LMNA (0.39) KDM4EALDH1A1MAPTSMN1; SMN2HPGD
SCHEMBL7519440 0.74 TSHR (0.46) TSHRKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL7503519 0.73 TSHR (0.45) TSHRKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL15033450 0.72 TSHR (0.47) TSHRKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL9523406 0.72 TSHR (0.44) TSHRKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL27315765 0.72 TSHR (0.44) TSHRKDM4EALDH1A1MAPTSMN1; SMN2
SCHEMBL7509246 0.71 TSHR (0.46) TSHRKDM4EALDH1A1MAPTSMN1; 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
JP-2134369-A None JP disclosed
US-5045557-A Imidazable fungicides and use thereof SCHERING AGROCHEMICALS LTD. (GB) 1991-09-03 US disclosed
JP-H02134369-A IMIDAZOLE-BASED COMPOUND ISHIHARA SANGYO KAISHA LTD 1990-05-23 JP disclosed
EP-0284277-A1 Cyanoimidazole fungicides AgrEvo UK Limited (GB) 1988-09-28 EP disclosed