SCHEMBL5674128

SCHEMBL5674128

c1ccc(SNC2CCCCC2)nc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
KMT2A Q03164 1/20 0.51
HPGD P15428 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
KDM4E B2RXH2 2/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.44
EHMT2 Q96KQ7 1/20 0.44
EHMT1 Q9H9B1 1/20 0.44
APOBEC3G Q9HC16 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.42
CNR1 P21554 2/20 0.42
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
GRM5 P41594 2/20 0.39
CYP1A2 P05177 1/20 0.39
EPHX2 P34913 1/20 0.39
GPR39 O43194 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
SCHEMBL5676704 0.78 KDM4E (0.52) ALDH1A1KMT2AHPGDTDP1KDM4E
SCHEMBL8746162 0.78 CNR1 (0.41) ALDH1A1KMT2AHPGDTDP1KDM4E
SCHEMBL8858684 0.78 CNR1 (0.44) ALDH1A1KMT2AHPGDTDP1KDM4E
SCHEMBL9175317 0.76 CNR1 (0.39) ALDH1A1KMT2AHPGDTDP1KDM4E
SCHEMBL28455598 0.73 EHMT2 (0.48) ALDH1A1KMT2AHPGDKDM4EGAA
SCHEMBL12949631 0.73 EHMT2 (0.48) ALDH1A1KMT2AHPGDKDM4EGAA
SCHEMBL15271760 0.73 EHMT2 (0.48) ALDH1A1KMT2AHPGDKDM4EGAA
SCHEMBL6024930 0.72 ALDH1A1 (0.49) ALDH1A1KMT2AHPGDTDP1KDM4E
SCHEMBL15271518 0.71 EHMT2 (0.50) ALDH1A1KMT2AHPGDTDP1KDM4E
SCHEMBL22882906 0.70 EHMT2 (0.55) ALDH1A1KMT2AHPGDKDM4EGAA

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6245912-B1 FROM THE SULFENAMIDE AND AN ALDEHYDE; USED AS VULCANIZATION ACCELERATOR OR A PESTICIDE UNIROYAL CHEMICAL COMPANY, INC. 2001-06-12 US claimed
CN-106831750-B The oxidation of catalytic molecular oxygen generates the method with the sulfenamide compound of S-N key in water phase 郑州大学 2019-09-06 CN disclosed
CN-106831750-A The method of catalytic molecular oxygen oxidation sulfenamide compound of the generation with S N keys in water phase 郑州大学 2017-06-13 CN disclosed
EP-1200420-B1 PROCESS FOR MAKING N-ALKYL BIS(THIAZOLYL)SULFENIMIDES UNIROYAL CHEM CO INC (US) 2006-01-18 EP disclosed
EP-1200420-A1 PROCESS FOR MAKING N-ALKYL BIS(THIAZOLYL)SULFENIMIDES Uniroyal Chemical Company, Inc. (US) 2002-05-02 EP disclosed
US-6245912-B1 FROM THE SULFENAMIDE AND AN ALDEHYDE; USED AS VULCANIZATION ACCELERATOR OR A PESTICIDE UNIROYAL CHEMICAL COMPANY, INC. 2001-06-12 US disclosed
WO-2001009108-A1 PROCESS FOR MAKING N-ALKYL BIS(THIAZOLYL)SULFENIMIDES UNIROYAL CHEMICAL COMPANY, INC. (US) 2001-02-08 WO disclosed
US-6180795-B1 Process for making N-alkyl bis(thiazolyl)sulfenimides UNIROYAL CHEMICAL COMPANY, INC. 2001-01-30 US disclosed