SCHEMBL3972513

SCHEMBL3972513

COc1ccc(S(=O)(=O)Nc2ccc3c(-c4ccccc4Cl)n[nH]c3c2)cc1OC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.53
▸ HTT P42858 2/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ ALDH1A1 P00352 6/20 0.53
▸ MEN1 O00255 3/20 0.53
▸ KMT2A Q03164 3/20 0.53
▸ PKM P14618 2/20 0.53
▸ TSHR P16473 2/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.53
▸ CYP1A2 P05177 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ CA12 O43570 1/20 0.51
▸ CA9 Q16790 1/20 0.51
▸ GAA P10253 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ KEAP1 Q14145 1/20 0.49
▸ NFE2L2 Q16236 1/20 0.49
▸ MAP2K4 P45985 4/20 0.48
▸ TOP2A P11388 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
SCHEMBL3971858 0.88 MAP2K4 (0.56) ALDH1A1PKMKEAP1NFE2L2MAP2K4
SCHEMBL3966079 0.86 MAP2K4 (0.57) GAAKEAP1NFE2L2MAP2K4
SCHEMBL3966356 0.86 PKM (0.56) MEN1KMT2APKMMAP2K4TP53
SCHEMBL3968695 0.86 TP53 (0.58) LMNAHTTSMN1; SMN2PKMTSHR
SCHEMBL3973325 0.85 MAP2K4 (0.51) LMNASMN1; SMN2MEN1KMT2APKM
SCHEMBL3969942 0.85 MAP2K4 (0.54) LMNAALDH1A1CYP2C19L3MBTL1MAP2K4
SCHEMBL3969192 0.85 SMN1; SMN2 (0.54) LMNASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL3971253 0.85 TP53 (0.56) LMNAHTTSMN1; SMN2ALDH1A1MEN1
SCHEMBL3963379 0.85 MAP2K4 (0.56) MEN1KMT2AGAAMAP2K4MAPT
SCHEMBL3966208 0.85 MAP2K4 (0.56) ALDH1A1MAP2K4

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 7 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
CN-101243051-A P38 MAP kinase inhibitors and methods for using the same HOFFMANN LA ROCHE (CH) 2008-08-13 — — CN 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 LMNA 1784/4885HTT 4518/4885SMN1; SMN2 1600/4885

“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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