SCHEMBL3968695

SCHEMBL3968695

COc1ccc(Cl)cc1S(=O)(=O)Nc1ccc2c(-c3ccccc3Cl)n[nH]c2c1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 2/20 0.58
▸ BRD4 O60885 2/20 0.55
▸ ALPL P05186 4/20 0.53
▸ NPC1 O15118 1/20 0.52
▸ TSHR P16473 1/20 0.52
▸ PTPN2 P17706 2/20 0.49
▸ PTPN1 P18031 2/20 0.49
▸ PTPN5 P54829 2/20 0.49
▸ USP2 O75604 1/20 0.48
▸ NPSR1 Q6W5P4 2/20 0.48
▸ LMNA P02545 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ KAT6A Q92794 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ PPARG P37231 1/20 0.46
▸ SGK1 O00141 1/20 0.46
▸ PKM P14618 1/20 0.46

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
SCHEMBL3969192 0.92 SMN1; SMN2 (0.54) TP53BRD4ALPLTSHRNPSR1
SCHEMBL3971253 0.92 TP53 (0.56) TP53ALPLNPSR1LMNAHTT
SCHEMBL3966356 0.91 PKM (0.56) TP53BRD4SGK1PKM
SCHEMBL3968443 0.86 SGK1 (0.58) ALPLSGK1
SCHEMBL3972513 0.86 LMNA (0.53) TP53TSHRNPSR1LMNAHTT
SCHEMBL3962444 0.84 SGK1 (0.61) BRD4SGK1
SCHEMBL3964176 0.82 SGK1 (0.52) BRD4LMNASGK1
SCHEMBL3963379 0.82 MAP2K4 (0.56) BRD4SGK1
SCHEMBL3971858 0.82 MAP2K4 (0.56) BRD4PKM
SCHEMBL3966336 0.81 SGK1 (0.51) BRD4SGK1PKM

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 TP53 1156/4885BRD4 1764/4885ALPL 4388/4885

“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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