SCHEMBL6410631

SCHEMBL6410631

COc1ccc2[nH]c(-c3n[nH]c4sc(NS(=O)(=O)c5ccccc5)cc34)cc2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ITK Q08881 12/20 0.55
▸ BCAT1 P54687 1/20 0.46
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ SLC40A1 Q9NP59 1/20 0.40
▸ TUBB4A P04350 1/20 0.39
▸ TUBB P07437 1/20 0.39
▸ TUBA3C P0DPH7 1/20 0.39
▸ TUBA1B P68363 1/20 0.39
▸ TUBA4A P68366 1/20 0.39
▸ TUBB4B P68371 1/20 0.39
▸ TUBB3 Q13509 1/20 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
SCHEMBL6409034 0.89 ITK (0.52) ITKBCAT1MEN1KMT2AKDM4E
SCHEMBL6410524 0.86 ITK (0.52) ITKCHEK1
SCHEMBL6414608 0.75 ITK (0.38) ITKCA12CA1CA2CA9
SCHEMBL6411955 0.74 CKS1B (0.41) ITKCA1CA2CA9GAA
SCHEMBL1460968 0.71 ITK (0.60) ITK
SCHEMBL4782085 0.71 BCAT1 (0.49) BCAT1MEN1KMT2AKDM4ENPC1
SCHEMBL6414471 0.70 PTGES2 (0.41) BCAT1MEN1KMT2AKDM4ENPC1
SCHEMBL4782144 0.70 SLC40A1 (0.52) ITKBCAT1MEN1KMT2AKDM4E
SCHEMBL4008159 0.68 ITK (0.79) ITKAURKAAURKB
SCHEMBL6410600 0.68 AURKA (0.47) CA12CA1CA2CA9CHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050026984-A1 Substituted thieno [2,3-c] pyrazoles and their use as medicinal products AVENTIS PHARMA S.A. (FR) 2005-02-03 — — 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-20050026984-A1 Substituted thieno [2,3-c] pyrazoles and their use as medicinal products TPMT, PARK7, PRNP ITK 2307/4885BCAT1 2316/4885MEN1 1890/4885

“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.

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