SCHEMBL3082016

SCHEMBL3082016

S=C(S)Nc1cc2ccccc2[nH]1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GRIK1 P39086 1/20 0.45
▸ FLT3 P36888 1/20 0.42
▸ NPC1 O15118 3/20 0.41
▸ RAB9A P51151 3/20 0.41
▸ LMNA P02545 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ AOC3 Q16853 2/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ MAPT P10636 3/20 0.41
▸ DAO P14920 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ SRD5A2 P31213 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ DDO Q99489 1/20 0.41
▸ ALDH1A1 P00352 4/20 0.40
▸ GAA P10253 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39

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
SCHEMBL3068361 0.84 GRIK1 (0.49) GRIK1FLT3NPC1RAB9ALMNA
SCHEMBL4506884 0.82 GRIK1 (0.45) GRIK1FLT3NPC1RAB9ALMNA
SCHEMBL4506889 0.82 AOC3 (0.46) GRIK1FLT3NPC1RAB9ALMNA
SCHEMBL8118597 0.78 KDM4E (0.45) GRIK1FLT3NPC1RAB9ALMNA
SCHEMBL9269321 0.76 GRIK1 (0.56) GRIK1FLT3NPC1RAB9ALMNA
SCHEMBL3073852 0.75 GRIK1 (0.45) GRIK1FLT3NPC1RAB9ALMNA
SCHEMBL927313 0.75 AOC3 (0.46) GRIK1FLT3NPC1RAB9ALMNA
SCHEMBL31487774 0.75 MTNR1A (0.53) GRIK1FLT3NPC1RAB9ALMNA
SCHEMBL5515054 0.75 GRIK1 (0.51) GRIK1FLT3NPC1RAB9ALMNA
SCHEMBL5493171 0.75 KDM4E (0.51) GRIK1FLT3NPC1RAB9ALMNA

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110845413-A Dithiocarbamate compounds and preparation method and application thereof 华南农业大学 2020-02-28 — — CN claimed
CN-115429794-B Application of 3-methylindole dimethyl amino dithioate in preparation of medicines for preventing and treating periodontitis 温州医科大学附属口腔医院 2023-11-17 — — CN disclosed
CN-115429794-A Application of 3-methylindole dimethyl amino dithioester in preparation of medicine for preventing and treating periodontitis 温州医科大学附属口腔医院 2022-12-06 — — CN disclosed
CN-110845413-B Dithiocarbamate compounds and preparation method and application thereof 华南农业大学 2021-04-23 — — CN disclosed
CN-110845413-B Dithiocarbamate compounds and preparation method and application thereof 华南农业大学 2021-04-23 — — CN disclosed
CN-110845413-A Dithiocarbamate compounds and preparation method and application thereof 华南农业大学 2020-02-28 — — CN disclosed
CN-110845413-A Dithiocarbamate compounds and preparation method and application thereof 华南农业大学 2020-02-28 — — CN disclosed
US-7833331-B2 Non-toxic corrosion-protection pigments based on cobalt UNIVERSITY OF DAYTON (US) 2010-11-16 — — US disclosed
US-7789958-B2 Non-toxic corrosion-protection pigments based on manganese UNIVERSITY OF DAYTON (US) 2010-09-07 — — US disclosed
US-20090163628-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON COBALT STURGILL JEFFREY ALLEN 2009-06-25 — — US disclosed
WO-2004065305-A1 NON-TOXIC CORROSION-PROTECTION PIGMENTS BASED ON MANGANESE UNIVERSITY OF DAYTON (US) 2004-08-05 — — WO disclosed
US-20040104377-A1 Non-toxic corrosion-protection pigments based on rare earth elements UNIVERSITY OF DAYTON 2004-06-03 — — US disclosed
US-20040020568-A1 Non-toxic corrosion-protection conversion coats based on rare earth elements DAYTON, UNIVERSITY OF 2004-02-05 — — US disclosed
US-20040016910-A1 Non-toxic corrosion-protection rinses and seals based on rare earth elements DAYTON, UNIVERSITY OF 2004-01-29 — — US disclosed
US-20040011252-A1 Non-toxic corrosion-protection pigments based on manganese UNIVERSITY OF DAYTON 2004-01-22 — — US disclosed
US-20030234063-A1 Non-toxic corrosion-protection conversion coats based on cobalt DAYTON, UNIVERSITY OF 2003-12-25 — — US disclosed
US-20030230363-A1 Non-toxic corrosion-protection rinses and seals based on cobalt UNIVERSITY OF DAYTON 2003-12-18 — — US disclosed
WO-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 — — WO disclosed
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 — — WO disclosed
WO-2003060019-A1 NON-TOXIC CORROSION PROTECTION PIGMENTS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 — — WO disclosed
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