SCHEMBL3968443

SCHEMBL3968443

O=S(=O)(Nc1ccc2c(-c3ccccc3Cl)n[nH]c2c1)c1cc(Cl)ccc1F

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SGK1 O00141 11/20 0.58
▸ MAP2K4 P45985 4/20 0.50
▸ HSP90AA1 P07900 1/20 0.47
▸ HSP90AB1 P08238 1/20 0.47
▸ ALPL P05186 2/20 0.47
▸ ITGA1 P56199 1/20 0.46
▸ ACLY P53396 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
SCHEMBL3971235 0.93 SGK1 (0.56) SGK1MAP2K4
SCHEMBL3964181 0.92 SGK1 (0.57) SGK1MAP2K4
SCHEMBL3968444 0.91 MAP2K4 (0.49) SGK1MAP2K4
SCHEMBL3962444 0.87 SGK1 (0.61) SGK1MAP2K4ITGA1
SCHEMBL3967746 0.87 MAP2K4 (0.55) SGK1MAP2K4
SCHEMBL3972626 0.87 MAP2K4 (0.52) SGK1MAP2K4ACLY
SCHEMBL3970942 0.87 MAP2K4 (0.56) SGK1MAP2K4
SCHEMBL3968695 0.86 TP53 (0.58) SGK1ALPL
SCHEMBL3968870 0.86 MAP2K4 (0.56) MAP2K4
SCHEMBL3963379 0.85 MAP2K4 (0.56) SGK1MAP2K4

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 SGK1 457/4885MAP2K4 101/4885HSP90AA1 902/4885

“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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