SCHEMBL15538488

SCHEMBL15538488

COC(=O)c1ncccc1CSCc1cnc(Cl)cc1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPO P05164 1/20 0.45
L3MBTL1 Q9Y468 3/20 0.44
PARP1 P09874 1/20 0.41
MAPT P10636 3/20 0.37
PKM P14618 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
KDM4E B2RXH2 2/20 0.35
HPGD P15428 1/20 0.35
GRM4 Q14833 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
HSP90AA1 P07900 1/20 0.35
BRD4 O60885 1/20 0.35
HTT P42858 3/20 0.34
ALOX15 P16050 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALDH1A1 P00352 3/20 0.34
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34

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
SCHEMBL15537738 0.85 PARP1 (0.41) MPOL3MBTL1PARP1MAPTKDM4E
SCHEMBL17667521 0.77 L3MBTL1 (0.42) MPOL3MBTL1PARP1MAPTPKM
SCHEMBL9957265 0.74 L3MBTL1 (0.46) MPOL3MBTL1PARP1PKMTDP1
SCHEMBL28677368 0.74 L3MBTL1 (0.57) MPOL3MBTL1PARP1MAPTPKM
SCHEMBL15538491 0.74 L3MBTL1 (0.46) MPOL3MBTL1PARP1KDM4EGRM4
SCHEMBL25414723 0.72 L3MBTL1 (0.55) MPOL3MBTL1PARP1MAPTPKM
SCHEMBL535668 0.72 L3MBTL1 (0.58) MPOL3MBTL1PARP1MAPTPKM
SCHEMBL15537739 0.70 L3MBTL1 (0.40) L3MBTL1KDM4EGRM4KMT2AHTT
SCHEMBL128967 0.70 L3MBTL1 (0.55) MPOL3MBTL1PARP1MAPTPKM
SCHEMBL1979301 0.70 L3MBTL1 (0.55) MPOL3MBTL1PARP1MAPTPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150181879-A1 Substituted pyridine compounds having herbicidal activity BASF SE (DE) 2015-07-02 US disclosed
US-20150181879-A1 Substituted pyridine compounds having herbicidal activity BASF SE (DE) 2015-07-02 US disclosed
US-20150181879-A1 Substituted pyridine compounds having herbicidal activity BASF SE (DE) 2015-07-02 US disclosed
EP-2855485-A1 SUBSTITUTED PYRIDINE COMPOUNDS HAVING HERBICIDAL ACTIVITY BASF SE (DE) 2015-04-08 EP disclosed
WO-2013178585-A1 SUBSTITUTED PYRIDINE COMPOUNDS HAVING HERBICIDAL ACTIVITY BASF SE (DE) 2013-12-05 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 (1 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-20150181879-A1 Substituted pyridine compounds having herbicidal activity DDT, PNPO, CYP4X1 MPO 303/4885L3MBTL1 4546/4885PARP1 3856/4885

“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.