SCHEMBL22554841

SCHEMBL22554841

Cc1ccc(S(=O)(=O)NCc2cc(C)ccc2Br)cc1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.59
▸ KMT2A Q03164 2/20 0.59
▸ CYP19A1 P11511 1/20 0.56
▸ CYP1A2 P05177 2/20 0.54
▸ CYP3A4 P08684 2/20 0.54
▸ CA12 O43570 1/20 0.54
▸ ATM Q13315 1/20 0.54
▸ CA9 Q16790 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ ALDH1A1 P00352 7/20 0.53
▸ LMNA P02545 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ THRB P10828 1/20 0.48
▸ CYP2C19 P33261 1/20 0.47

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
SCHEMBL29128000 0.84 KMT2A (0.72) MEN1KMT2ACYP19A1CYP1A2CYP3A4
SCHEMBL14902028 0.81 MEN1 (0.71) MEN1KMT2ACYP19A1CYP1A2CYP3A4
SCHEMBL19826871 0.77 KMT2A (0.54) MEN1KMT2ACYP19A1CYP1A2CYP3A4
SCHEMBL25547142 0.74 CA12 (0.83) MEN1KMT2ACYP19A1CYP1A2CYP3A4
SCHEMBL12406975 0.74 KMT2A (1.00) MEN1KMT2ACYP19A1CYP1A2CYP3A4
SCHEMBL5960052 0.74 CA12 (0.71) MEN1KMT2ACYP19A1CYP1A2CYP3A4
SCHEMBL3925035 0.74 CA12 (0.71) MEN1KMT2ACYP19A1CYP1A2CYP3A4
SCHEMBL23451385 0.73 ALDH1A1 (0.60) MEN1KMT2ACYP1A2CYP3A4CA12
SCHEMBL12530337 0.73 MEN1 (0.64) MEN1KMT2ACYP19A1CYP1A2CYP3A4
SCHEMBL29019359 0.73 MEN1 (0.56) MEN1KMT2ACYP19A1CYP1A2CYP3A4

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-11548888-B2 KRas G12C inhibitors Mirati Therapeutics, Inc. (US) 2023-01-10 — — US disclosed
US-20200331911-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. 2020-10-22 — — 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 (2 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-11548888-B2 KRas G12C inhibitors KRAS, NRAS, HRAS MEN1 348/4885KMT2A 2081/4885CYP19A1 4008/4885
US-20200331911-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS MEN1 348/4885KMT2A 2081/4885CYP19A1 4008/4885

“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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