SCHEMBL9864223

SCHEMBL9864223

NC(=O)OSSCCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.50
NOS1 P29475 2/20 0.46
KEAP1 Q14145 1/20 0.42
TDP1 Q9NUW8 3/20 0.42
MAPK1 P28482 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HDAC2 Q92769 2/20 0.40
HDAC8 Q9BY41 2/20 0.40
HDAC6 Q9UBN7 2/20 0.40
CES1 P23141 1/20 0.40
HDAC3 O15379 1/20 0.40
ADRA1A P35348 1/20 0.40
HDAC4 P56524 1/20 0.40
SLC6A3 Q01959 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40

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
SCHEMBL11585690 0.72 IDO1 (0.48) LMNANOS1TDP1SMN1; SMN2CES1
SCHEMBL11794976 0.71 KDM4E (0.44) LMNATDP1SMN1; SMN2ALDH1A1KMT2A
SCHEMBL3078052 0.71 IDO1 (0.41) LMNANOS1TDP1ALDH1A1CYP2C19
Urea SCHEMBL2006220 0.71 FFAR1 (0.62) LMNANOS1KEAP1TDP1MAPK1
Carbamic Acid SCHEMBL2222080 0.71 FFAR1 (0.62) LMNANOS1KEAP1TDP1MAPK1
SCHEMBL6049236 0.71 NOS1 (0.64) LMNANOS1KEAP1MAPK1SMN1; SMN2
SCHEMBL4185660 0.71 ALDH1A1 (0.55) NOS1TDP1SMN1; SMN2ALDH1A1CYP1A2
SCHEMBL13734757 0.70 NOS1 (0.48) LMNANOS1KEAP1MAPK1SMN1; SMN2
Phenylethyl Carbamate SCHEMBL111316 0.69 LMNA (0.79) LMNAKEAP1TDP1MAPK1SMN1; SMN2
SCHEMBL8990052 0.69 CES1 (0.62) LMNANOS1KEAP1MAPK1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0427624-A1 Thermoplastic elastomer based on polynorbornene and polyvinyl chloride ELF ATOCHEM S.A. (FR) 1991-05-15 EP disclosed
EP-0384822-A1 Thermoplastic elastomer made of ethylene/alpha-olefin copolymer and polynorbornene ELF ATOCHEM S.A. (FR) 1990-08-29 EP disclosed