SCHEMBL9523406

SCHEMBL9523406

CN(C)S(=O)(=O)n1cc(-c2ccccc2)nc1C(N)=S

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.44
KDM4E B2RXH2 6/20 0.38
MAPT P10636 4/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
GAA P10253 2/20 0.38
ALDH1A1 P00352 6/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
HPGD P15428 1/20 0.37
GFER P55789 1/20 0.37
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
PKM P14618 1/20 0.36
HSD17B10 Q99714 1/20 0.35
HCRTR1 O43613 1/20 0.35
POLB P06746 1/20 0.35
HTT P42858 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TLR9 Q9NR96 1/20 0.35
SCD O00767 1/20 0.34

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
SCHEMBL9323988 0.77 GABRA2 (0.45) KDM4EMAPTNPC1RAB9AGAA
SCHEMBL9876901 0.77 LMNA (0.42) KDM4ENPC1RAB9AALDH1A1HPGD
SCHEMBL7519440 0.75 TSHR (0.46) TSHRKDM4EMAPTNPC1RAB9A
SCHEMBL7509246 0.75 TSHR (0.46) TSHRKDM4EMAPTNPC1RAB9A
SCHEMBL7503519 0.74 TSHR (0.45) TSHRKDM4EMAPTNPC1RAB9A
SCHEMBL7513475 0.73 TSHR (0.47) TSHRKDM4EMAPTNPC1RAB9A
SCHEMBL15033450 0.73 TSHR (0.47) TSHRKDM4EMAPTNPC1RAB9A
SCHEMBL9521448 0.72 TSHR (0.46) TSHRKDM4ENPC1RAB9AGAA
SCHEMBL9876370 0.72 TSHR (0.43) TSHRKDM4EMAPTNPC1RAB9A
SCHEMBL9876372 0.72 TSHR (0.43) TSHRKDM4EMAPTNPC1RAB9A

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
EP-0298196-B1 IMIDAZOLE COMPOUNDS AND BIOCIDAL COMPOSITIONS COMPRISING THE SAME ISHIHARA SANGYO KAISHA, LTD. (JP) 1993-06-02 EP disclosed
US-4995898-A Imidazole compounds and biocidal composition comprising the same for controlling harmful organisms ISHIHARA SANGYO KAISHA, LTD. (JP) 1991-02-26 US disclosed
EP-0298196-A1 Imidazole compounds and biocidal compositions comprising the same ISHIHARA SANGYO KAISHA, LTD. (JP) 1989-01-11 EP disclosed