SCHEMBL205865

SCHEMBL205865

N#Cc1ccc(-c2c[nH]c(Nc3ccc(OCCCC4CCCC4)c(C(F)(F)F)c3)c2)cn1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTSS P25774 9/20 0.40
CTSK P43235 4/20 0.40
CHEK1 O14757 11/20 0.39

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
SCHEMBL207559 0.81 CHEK1 (0.41) CTSSCTSKCHEK1
SCHEMBL208851 0.79 HPGD (0.40) CTSS
SCHEMBL206266 0.69 ALDH1A1 (0.42)
SCHEMBL17654340 0.69 HPGD (0.46) CTSSCTSK
SCHEMBL205364 0.68 MCHR1 (0.39)
SCHEMBL3130600 0.68 CHRNA7 (0.36) CTSS
SCHEMBL205730 0.68 MCHR1 (0.40)
SCHEMBL2697660 0.67 HPGD (0.39) CTSS
SCHEMBL207006 0.67 ALOX5 (0.45)
SCHEMBL205538 0.67 VCP (0.43) CTSSCTSKCHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088806-B2 Thiazole compounds and methods of use ACHILLION PHARMACEUTICALS, INC. (US) 2012-01-03 US disclosed
US-20070004711-A1 Thiazole compounds and methods of use ACHILLION PHARMACEUTICALS, INC. 2007-01-04 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 (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-20070004711-A1 Thiazole compounds and methods of use PIGS, CPT1A, SLC10A1 CTSS 1721/4885CTSK 3395/4885CHEK1 3562/4885

“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.