SCHEMBL11352440

SCHEMBL11352440

O=C(O)Nc1cccc(SCc2ccccc2)c1SCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.47
▸ L3MBTL1 Q9Y468 3/20 0.47
▸ POLB P06746 2/20 0.45
▸ PTPRC P08575 1/20 0.43
▸ MEN1 O00255 4/20 0.42
▸ MAPT P10636 3/20 0.42
▸ SAE1 Q9UBE0 1/20 0.42
▸ UBA2 Q9UBT2 1/20 0.42
▸ HPGD P15428 5/20 0.41
▸ LMNA P02545 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.41
▸ ATM Q13315 2/20 0.41
▸ KDM4E B2RXH2 3/20 0.40
▸ HTT P42858 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ HDAC3 O15379 1/20 0.38
▸ NCOR1 O75376 1/20 0.38

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
SCHEMBL11357236 0.87 KMT2A (0.51) KMT2AL3MBTL1POLBPTPRCMEN1
SCHEMBL15953118 0.75 POLB (0.55) KMT2AL3MBTL1POLBPTPRCMEN1
SCHEMBL7831365 0.75 KMT2A (0.56) KMT2AL3MBTL1POLBPTPRCMEN1
SCHEMBL9118538 0.72 POLB (0.59) KMT2AL3MBTL1POLBPTPRCMEN1
SCHEMBL16670318 0.72 POLB (0.55) KMT2AL3MBTL1POLBPTPRCMEN1
SCHEMBL8373225 0.70 POLB (0.53) KMT2AL3MBTL1POLBPTPRCMEN1
SCHEMBL4962048 0.70 POLB (0.53) KMT2AL3MBTL1POLBPTPRCMEN1
SCHEMBL8631418 0.70 POLB (0.53) KMT2AL3MBTL1POLBPTPRCMEN1
SCHEMBL11349579 0.70 TDP1 (0.55) KMT2AL3MBTL1POLBMEN1MAPT
SCHEMBL15577067 0.70 POLB (0.49) KMT2AL3MBTL1POLBPTPRCMEN1

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-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
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