SCHEMBL6977306

SCHEMBL6977306

COc1ccc(CC(c2ccc(Cl)nc2)S(C)(=O)=NC#N)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 6/20 0.37
LMNA P02545 3/20 0.37
GAA P10253 2/20 0.37
GRM2 Q14416 1/20 0.37
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPC1 O15118 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
RAB9A P51151 1/20 0.34
TERT O14746 2/20 0.34
POLB P06746 2/20 0.33
NFE2L2 Q16236 1/20 0.33
NPBWR1 P48145 1/20 0.33
MAPT P10636 1/20 0.33
LDHA P00338 1/20 0.33
APLNR P35414 2/20 0.33
MAPK1 P28482 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
SCHEMBL6981129 0.89 MEN1 (0.39) MEN1KMT2ASMN1; SMN2
SCHEMBL6980483 0.89 CHRNB2 (0.36) MEN1KMT2AALDH1A1GAASMN1; SMN2
SCHEMBL6984833 0.87 CYP1A2 (0.36) CYP1A2CYP2D6CYP2C19POLBLDHA
SCHEMBL12797914 0.87 GAA (0.40) MEN1KMT2AALDH1A1LMNAGAA
SCHEMBL12797912 0.81 MAPT (0.37) MEN1KMT2AALDH1A1GAACYP2D6
SCHEMBL6980484 0.80 SMN1; SMN2 (0.32) ALDH1A1CYP2D6SMN1; SMN2NFE2L2MAPT
SCHEMBL6980496 0.80 SMN1; SMN2 (0.33) ALDH1A1CYP2D6SMN1; SMN2POLBMAPT
SCHEMBL6979577 0.78 SMN1; SMN2 (0.33) ALDH1A1CYP2D6SMN1; SMN2MAPT
SCHEMBL2407574 0.77 SLC6A3 (0.35)
SCHEMBL6977343 0.77 SMN1; SMN2 (0.32) ALDH1A1CYP2D6SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8183268-B2 Heteroaryl (substituted)alkyl N-substituted sulfoximines as insecticides DOW AGROSCIENCES, LLC. (US) 2012-05-22 US disclosed
US-8017788-B2 Heteroaryl (substituted)alkyl N-substituted sulfoximines as insecticides DOW AGROSCIENCES LLC (US) 2011-09-13 US disclosed
US-8017788-B2 Heteroaryl (substituted)alkyl N-substituted sulfoximines as insecticides DOW AGROSCIENCES LLC (US) 2011-09-13 US disclosed
US-20100173962-A1 HETEROARYL (SUBSTITUTED)ALKYL N-SUBSTITUTED SULFOXIMINES AS INSECTICIDES DOW AGROSCIENCES LLC (US) 2010-07-08 US disclosed
US-20100173950-A1 HETEROARYL (SUBSTITUTED)ALKYL N-SUBSTITUTED SULFOXIMINES AS INSECTICIDES CORTEVA AGRISCIENCE LLC 2010-07-08 US disclosed
US-20100173962-A1 HETEROARYL (SUBSTITUTED)ALKYL N-SUBSTITUTED SULFOXIMINES AS INSECTICIDES DOW AGROSCIENCES LLC (US) 2010-07-08 US disclosed
US-20100173950-A1 HETEROARYL (SUBSTITUTED)ALKYL N-SUBSTITUTED SULFOXIMINES AS INSECTICIDES CORTEVA AGRISCIENCE LLC 2010-07-08 US disclosed
US-20100168172-A1 HETEROARYL (SUBSTITUTED)ALKYL N-SUBSTITUTED SULFOXIMINES AS INSECTICIDES CORTEVA AGRISCIENCE LLC 2010-07-01 US disclosed
US-7705156-B2 Heteroaryl (substituted)alkyl N-substituted sulfoximines as insecticides DOW AGROSCIENCES LLC (US) 2010-04-27 US disclosed
US-7705156-B2 Heteroaryl (substituted)alkyl N-substituted sulfoximines as insecticides DOW AGROSCIENCES LLC (US) 2010-04-27 US disclosed
US-20080108666-A1 Heteroaryl (substituted)alkyl N-substituted sulfoximines as insecticides CORTEVA AGRISCIENCE LLC 2008-05-08 US disclosed
US-20080108666-A1 Heteroaryl (substituted)alkyl N-substituted sulfoximines as insecticides CORTEVA AGRISCIENCE LLC 2008-05-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080108666-A1 Heteroaryl (substituted)alkyl N-substituted sulfoximines as insecticides STS, DDT, TST MEN1 3884/4885KMT2A 143/4885ALDH1A1 2819/4885
US-20100173962-A1 HETEROARYL (SUBSTITUTED)ALKYL N-SUBSTITUTED SULFOXIMINES AS INSECTICIDES STS, DDT, TST MEN1 3884/4885KMT2A 143/4885ALDH1A1 2819/4885
US-20100173950-A1 HETEROARYL (SUBSTITUTED)ALKYL N-SUBSTITUTED SULFOXIMINES AS INSECTICIDES STS, DDT, TST MEN1 3884/4885KMT2A 143/4885ALDH1A1 2819/4885
US-20100168172-A1 HETEROARYL (SUBSTITUTED)ALKYL N-SUBSTITUTED SULFOXIMINES AS INSECTICIDES STS, DDT, TST MEN1 3884/4885KMT2A 143/4885ALDH1A1 2819/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.