SCHEMBL20640658

SCHEMBL20640658

CS(=O)(=O)OCCC(Nc1nc(Cl)ncc1Cl)C(F)F

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
STK17B O94768 1/20 0.34
STK17A Q9UEE5 1/20 0.34
LRRK2 Q5S007 1/20 0.32
MEN1 O00255 1/20 0.30
AGTR1 P30556 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
TLR9 Q9NR96 1/20 0.30
S100A9 P06702 1/20 0.30

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
SCHEMBL20640625 0.85 GLP1R (0.36) STK17BSTK17ALRRK2S100A9
SCHEMBL20640705 0.83 CRHR1 (0.34) STK17BSTK17ALRRK2TLR9S100A9
SCHEMBL20640650 0.82 STK17B (0.34) STK17BSTK17A
SCHEMBL20640562 0.78 STK17B (0.34) STK17BSTK17AKMT2A
SCHEMBL20652182 0.74 STK17B (0.40) STK17BSTK17ALRRK2MEN1AGTR1
SCHEMBL2062265 0.68 GLP1R (0.39) STK17BSTK17ALRRK2TLR9S100A9
SCHEMBL20652482 0.67 STK17B (0.36) STK17BSTK17AKMT2A
SCHEMBL1935476 0.66 KDM4E (0.45) STK17BSTK17AMEN1RAB9AKMT2A
SCHEMBL1024220 0.66 ALK (0.40)
SCHEMBL1935093 0.66 TDP1 (0.42) STK17BSTK17ALRRK2MEN1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200392158-A1 INHIBITORS OF LEUCINE RICH REPEAT KINASE 2 GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-12-17 US disclosed
US-20200392158-A1 INHIBITORS OF LEUCINE RICH REPEAT KINASE 2 GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2020-12-17 US disclosed
EP-3652179-A1 INHIBITORS OF LEUCINE RICH REPEAT KINASE 2 GlaxoSmithKline Intellectual Property Development Ltd (GB) 2020-05-20 EP disclosed
CN-110891954-A Inhibitors of leucine-rich repeat kinase 2 葛兰素史密斯克莱知识产权发展有限公司 2020-03-17 CN disclosed
WO-2019012093-A1 INHIBITORS OF LEUCINE RICH REPEAT KINASE 2 GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-01-17 WO disclosed
WO-2019012093-A1 INHIBITORS OF LEUCINE RICH REPEAT KINASE 2 GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-01-17 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-20200392158-A1 INHIBITORS OF LEUCINE RICH REPEAT KINASE 2 LRRK2, PARK7, PINK1 STK17B 204/4885STK17A 264/4885LRRK2 1/4885

“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.