SCHEMBL10351900

SCHEMBL10351900

CC(C)Sc1ccccc1NC(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CETP P11597 3/20 0.53
TP53 P04637 4/20 0.49
MDM4 O15151 2/20 0.49
MDM2 Q00987 2/20 0.49
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
L3MBTL1 Q9Y468 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
MAPT P10636 2/20 0.42
ALDH1A1 P00352 5/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
ITGB3 P05106 1/20 0.41
ITGAV P06756 1/20 0.41
ITGA2B P08514 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSD17B10 Q99714 1/20 0.41
POLB P06746 1/20 0.41
BLM P54132 1/20 0.41

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
SCHEMBL28024836 0.86 CETP (0.53) CETPTP53MDM4MDM2KMT2A
SCHEMBL10351503 0.85 CETP (0.41) CETPTP53MDM4MDM2KMT2A
SCHEMBL11364195 0.85 CETP (0.49) CETPTP53MDM4MDM2KMT2A
SCHEMBL2935482 0.81 KMT2A (0.68) TP53KMT2AMEN1L3MBTL1TDP1
SCHEMBL13846423 0.78 MAPT (0.51) CETPTP53MDM4MDM2KMT2A
SCHEMBL30513842 0.77 CETP (0.44) CETPTP53MDM4MDM2KMT2A
SCHEMBL3690292 0.76 TDP1 (0.50) CETPTP53MDM4MDM2KMT2A
SCHEMBL16204250 0.75 ADRA2C (0.44) CETPTP53MDM4MDM2L3MBTL1
SCHEMBL11518250 0.75 ITGB3 (0.50) CETPTP53MDM4MDM2KMT2A
SCHEMBL4654049 0.74 TDP1 (0.72) KMT2AMEN1L3MBTL1TDP1MAPT

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-0008177-B1 VULCANIZABLE RUBBER COMPOSITIONS CONTAINING SUBSTITUTED CARBAMIC ACID ESTERS MONSANTO COMPANY (US) 1981-08-26 EP disclosed
EP-0008177-A1 Vulcanizable rubber compositions containing substituted carbamic acid esters MONSANTO COMPANY (US) 1980-02-20 EP disclosed
US-4156680-A Scorch inhibited vulcanizable rubber compositions containing carbamic acid esters MONSANTO COMPANY (US) 1979-05-29 US disclosed