SCHEMBL21133848

SCHEMBL21133848

COc1ccc(C(C)(C)S)nc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN10A Q9Y5Y9 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
PKM P14618 2/20 0.38
MMP13 P45452 1/20 0.38
TUBB4A P04350 1/20 0.36
TUBB P07437 1/20 0.36
TUBA3C P0DPH7 1/20 0.36
TUBA1B P68363 1/20 0.36
TUBA4A P68366 1/20 0.36
TUBB4B P68371 1/20 0.36
TUBB3 Q13509 1/20 0.36
TUBB2A Q13885 1/20 0.36
TUBB8 Q3ZCM7 1/20 0.36
TUBA3E Q6PEY2 1/20 0.36
TUBA1A Q71U36 1/20 0.36

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
SCHEMBL10220768 0.83 CA12 (0.42) SCN10ACA12CA1CA2CA7
SCHEMBL1511036 0.81 HSD11B1 (0.41) SCN10ACA12CA1CA2CA7
SCHEMBL17966038 0.80 PDE10A (0.40) SCN10ACA12CA1CA2CA7
SCHEMBL30947604 0.80 HSD11B1 (0.39) SCN10ACA12CA1CA2CA7
SCHEMBL20793240 0.79 MMP13 (0.45) SCN10ACA12CA1CA2CA7
Formaldehyde SCHEMBL28302295 0.78 PKM (0.41) SCN10ACA12CA1CA2CA7
SCHEMBL929327 0.78 TRPV4 (0.52) SCN10ACA12CA1CA2CA7
SCHEMBL18481687 0.77 CA12 (0.36) SCN10ACA12CA1CA2CA7
SCHEMBL31130640 0.76 TRPV4 (0.50) SCN10ACA12CA1CA2CA7
SCHEMBL25227094 0.74 CA12 (0.37) CA12CA1CA2CA7CA9

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-10344016-B2 Bromotriazole intermediates AMGEN INC. (US) 2019-07-09 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-10344016-B2 Bromotriazole intermediates APH1A, BRDT, APH1B SCN10A 4138/4885CA12 4324/4885CA1 3788/4885

“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.