SCHEMBL17196823

SCHEMBL17196823

CC(=O)SCc1cccc(N(C)S(C)(=O)=O)c1C(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.37
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PTK2 Q05397 5/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MEN1 O00255 2/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
PTK2B Q14289 1/20 0.33
HSD17B10 Q99714 1/20 0.33
HDAC3 O15379 1/20 0.32
HDAC4 P56524 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC7 Q8WUI4 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC10 Q969S8 1/20 0.32
HDAC11 Q96DB2 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32

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
SCHEMBL17187943 0.81 KMT2A (0.39) KMT2ATSHRSMN1; SMN2PTK2L3MBTL1
SCHEMBL18804633 0.81 KMT2A (0.39) KMT2ATSHRSMN1; SMN2PTK2L3MBTL1
SCHEMBL14476816 0.79 DDR1 (0.35) KMT2AMEN1HDAC3HDAC4HDAC1
SCHEMBL17196886 0.78 KMT2A (0.37) KMT2ASMN1; SMN2PTK2MEN1ALDH1A1
SCHEMBL20246840 0.76 KMT2A (0.35) KMT2ASMN1; SMN2PTK2L3MBTL1NPSR1
SCHEMBL28113687 0.75 NPC1 (0.32) PTK2PTK2BCLK2AURKBCLK4
SCHEMBL17187891 0.73 BRD4 (0.38) KMT2APTK2MEN1HSD17B10
SCHEMBL20246839 0.73 PTK2 (0.36) KMT2APTK2MEN1PTK2BHSD17B10
SCHEMBL17187948 0.72 PTK2 (0.41) KMT2ATSHRSMN1; SMN2PTK2L3MBTL1
SCHEMBL17187868 0.71 KMT2A (0.39) KMT2ATSHRSMN1; SMN2PTK2L3MBTL1

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-10023590-B2 Substituted pyridine compounds having herbicidal activity BASF SE (DE) 2018-07-17 US disclosed
US-10023590-B2 Substituted pyridine compounds having herbicidal activity BASF SE (DE) 2018-07-17 US disclosed
US-10023590-B2 Substituted pyridine compounds having herbicidal activity BASF SE (DE) 2018-07-17 US disclosed
EP-3131906-B1 SUBSTITUTED PYRIDINE COMPOUNDS HAVING HERBICIDAL ACTIVITY BASF SE (DE) 2018-06-13 EP disclosed
US-20170121343-A1 Substituted Pyridine Compounds Having Herbicidal Activity BASF SE (DE) 2017-05-04 US disclosed
US-20170121343-A1 Substituted Pyridine Compounds Having Herbicidal Activity BASF SE (DE) 2017-05-04 US disclosed
US-20170121343-A1 Substituted Pyridine Compounds Having Herbicidal Activity BASF SE (DE) 2017-05-04 US disclosed
WO-2015158565-A1 SUBSTITUTED PYRIDINE COMPOUNDS HAVING HERBICIDAL ACTIVITY BASF SE (DE) 2015-10-22 WO 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 (2 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-10023590-B2 Substituted pyridine compounds having herbicidal activity DDT, PNPO, CYP4X1 KMT2A 1337/4885TSHR 3053/4885SMN1; SMN2 3700/4885
US-20170121343-A1 Substituted Pyridine Compounds Having Herbicidal Activity DDT, PNPO, CYP4X1 KMT2A 1337/4885TSHR 3053/4885SMN1; SMN2 3700/4885

“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.