SCHEMBL3968449

SCHEMBL3968449

CC(=O)Nc1ccc(S(=O)(=O)Nc2ccc3c(-c4ccccc4Cl)n[nH]c3c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ TTK P33981 1/20 0.52
▸ AURKA O14965 1/20 0.51
▸ GAA P10253 3/20 0.49
▸ MAP2K4 P45985 3/20 0.48
▸ PKM P14618 2/20 0.47
▸ GFER P55789 1/20 0.47
▸ RXFP1 Q9HBX9 1/20 0.47
▸ MAP2K7 O14733 1/20 0.46
▸ ATM Q13315 1/20 0.46
▸ PLA2G7 Q13093 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ HTT P42858 1/20 0.45

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
SCHEMBL3965407 0.91 KMT2A (0.52) MEN1KMT2ARAB9ATTKAURKA
SCHEMBL3965414 0.90 MAP2K4 (0.57) TTKAURKAGAAMAP2K4MAP2K7
SCHEMBL3969942 0.88 MAP2K4 (0.54) AURKAMAP2K4MAP2K7ALDH1A1
SCHEMBL3963379 0.88 MAP2K4 (0.56) MEN1KMT2AAURKAGAAMAP2K4
SCHEMBL3966208 0.88 MAP2K4 (0.56) AURKAMAP2K4MAP2K7ALDH1A1
SCHEMBL3967980 0.86 MAP2K4 (0.62) MEN1KMT2AMAP2K4MAP2K7
SCHEMBL3971858 0.85 MAP2K4 (0.56) AURKAMAP2K4PKMMAP2K7ALDH1A1
SCHEMBL3973325 0.84 MAP2K4 (0.51) MEN1KMT2AAURKAMAP2K4PKM
SCHEMBL3966924 0.83 MAP2K4 (0.57) MEN1KMT2AAURKAMAP2K4MAP2K7
SCHEMBL3973335 0.83 MAP2K4 (0.56) AURKAMAP2K4MAP2K7

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-7517901-B2 p38 MAP kinase inhibitors and methods for using the same ROCHE PALO ALTO LLC (US) 2009-04-14 — — US disclosed
US-7517901-B2 p38 MAP kinase inhibitors and methods for using the same ROCHE PALO ALTO LLC (US) 2009-04-14 — — US disclosed
US-7517901-B2 p38 MAP kinase inhibitors and methods for using the same ROCHE PALO ALTO LLC (US) 2009-04-14 — — US disclosed
US-20070049633-A1 p38 MAP kinase inhibitors and methods for using the same ROCHE PALO ALTO LLC 2007-03-01 — — US disclosed
US-20070049633-A1 p38 MAP kinase inhibitors and methods for using the same ROCHE PALO ALTO LLC 2007-03-01 — — US disclosed
US-20070049633-A1 p38 MAP kinase inhibitors and methods for using the same ROCHE PALO ALTO LLC 2007-03-01 — — 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-20070049633-A1 p38 MAP kinase inhibitors and methods for using the same MAPK1, MAP3K1, MAP3K20 MEN1 2974/4885KMT2A 3163/4885RAB9A 1812/4885

“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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