SCHEMBL10351504

SCHEMBL10351504

CC(C)SOC(=O)N(SC(C)C)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
ATM Q13315 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SMN1; SMN2 Q16637 5/20 0.38
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.38
CHRNB2 P17787 1/20 0.36
CHRNB4 P30926 1/20 0.36
CHRNA3 P32297 1/20 0.36
CHRNA4 P43681 1/20 0.36
ALDH1A1 P00352 4/20 0.35
LMNA P02545 2/20 0.35
TP53 P04637 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CHRM4 P08173 2/20 0.33
CHRM3 P20309 2/20 0.33
CHRM2 P08172 1/20 0.33
CHRM5 P08912 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
SCHEMBL10351899 0.79 ALDH1A1 (0.41) NPSR1L3MBTL1ATMTDP1SMN1; SMN2
SCHEMBL11299784 0.79 ALDH1A1 (0.41) NPSR1L3MBTL1ATMTDP1SMN1; SMN2
SCHEMBL11272720 0.75 POLB (0.45) NPSR1SMN1; SMN2ALDH1A1LMNATP53
SCHEMBL10351366 0.72 SMN1; SMN2 (0.36) NPSR1L3MBTL1ATMTDP1SMN1; SMN2
SCHEMBL5190020 0.69 ALDH1A1 (0.45) SMN1; SMN2RAB9ANPC1ALDH1A1TP53
SCHEMBL28063121 0.68 TSHR (0.52) NPSR1ATMTDP1SMN1; SMN2RAB9A
SCHEMBL11364191 0.65 ALOX5 (0.40) NPSR1SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL11349580 0.63 L3MBTL1 (0.41) NPSR1L3MBTL1ATMTDP1SMN1; SMN2
SCHEMBL4210468 0.62 NPSR1 (0.46) NPSR1L3MBTL1ATMTDP1SMN1; SMN2
Fluoride SCHEMBL11042090 0.61 L3MBTL1 (0.39) NPSR1L3MBTL1ATMTDP1SMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0128891-B1 DEODORIZED COMPOSITIONS MONSANTO COMPANY (US) 1990-07-25 EP disclosed
US-4770806-A ACTIVATED CARBON AND ORGANIC SULFUR COMPOUND RUBBER ADDITIVE MONSANTO COMPANY (US) 1988-09-13 US disclosed
EP-0128891-A2 Deodorized compositions MONSANTO COMPANY (US) 1984-12-19 EP disclosed
EP-0007806-B1 N-SULFENYL DERIVATIVES OF DI(CARBAMIC ACID ESTERS) AND VULCANIZABLE RUBBER COMPOSITIONS CONTAINING THEM MONSANTO COMPANY (US) 1981-08-26 EP disclosed
EP-0007806-A1 N-Sulfenyl derivatives of di(carbamic acid esters) and vulcanizable rubber compositions containing them MONSANTO COMPANY (US) 1980-02-06 EP disclosed
US-4165310-A N-SULFENYL DERIVATIVES OF DI(CARBAMIC ACID ESTERS) USED AS PREMATURE VULCANIZING INHIBITORS MONSANTO COMPANY (US) 1979-08-21 US disclosed