SCHEMBL1522370

SCHEMBL1522370

CSc1ncc(C(=O)O)c(NCc2ccccc2)n1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 6/20 0.62
▸ THRB P10828 2/20 0.58
▸ RXFP1 Q9HBX9 3/20 0.51
▸ KDM5B Q9UGL1 1/20 0.49
▸ HTT P42858 1/20 0.48
▸ KDM4E B2RXH2 2/20 0.47
▸ ASPH Q12797 1/20 0.47
▸ RIOX2 Q8IUF8 1/20 0.47
▸ KDM8 Q8N371 1/20 0.47
▸ AGTR1 P30556 2/20 0.47
▸ AGTR2 P50052 2/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ HSD17B10 Q99714 1/20 0.47
▸ STAT6 P42226 1/20 0.47
▸ KDM6B O15054 1/20 0.46
▸ KDM4A O75164 1/20 0.46
▸ KDM4D Q6B0I6 1/20 0.46
▸ KDM4C Q9H3R0 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
SCHEMBL12904539 0.90 STAT6 (0.58) PPARGTHRBSTAT6
SCHEMBL16824948 0.87 KDM4E (0.54) PPARGTHRBRXFP1HTTKDM4E
SCHEMBL445955 0.86 ALDH1A1 (0.65) PPARGHTTKDM4ESMN1; SMN2HSD17B10
SCHEMBL28518019 0.82 PPARG (0.62) PPARGKDM5BAGTR1AGTR2SMN1; SMN2
SCHEMBL2225998 0.82 ALDH1A1 (0.53) PPARGTHRBHTTKDM4ESMN1; SMN2
SCHEMBL211691 0.82 STAT6 (0.50) PPARGTHRBRXFP1STAT6
SCHEMBL2900632 0.82 KDM4E (0.58) PPARGTHRBHTTKDM4ESMN1; SMN2
Fluoride SCHEMBL13517648 0.81 ALDH1A1 (0.52) PPARGTHRBHTTKDM4ESMN1; SMN2
SCHEMBL5658431 0.80 AURKA (0.44) PPARGTHRBRXFP1KDM4ESMN1; SMN2
SCHEMBL2554057 0.80 PPARG (0.51) PPARGTHRBRXFP1HTTSMN1; SMN2

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2202228-B1 AMIDE COMPOUNDS AND USE OF THE SAME TAKEDA PHARMACEUTICAL (JP) 2014-12-10 — — EP disclosed
EP-2202228-B1 AMIDE COMPOUNDS AND USE OF THE SAME TAKEDA PHARMACEUTICAL (JP) 2014-12-10 — — EP disclosed
US-8853230-B2 Inhibitors of JAK PORTOLA PHARMACEUTICALS, INC. (US) 2014-10-07 — — US disclosed
US-8853230-B2 Inhibitors of JAK PORTOLA PHARMACEUTICALS, INC. (US) 2014-10-07 — — US disclosed
US-20130137673-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-30 — — US disclosed
US-20130137673-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-30 — — US disclosed
US-8367689-B2 Inhibitors of JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-02-05 — — US disclosed
US-8367689-B2 Inhibitors of JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-02-05 — — US disclosed
US-8329691-B2 Amide compounds and use of the same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-12-11 — — US disclosed
US-8329691-B2 Amide compounds and use of the same TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-12-11 — — US disclosed
WO-2010129802-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2010-11-11 — — WO disclosed
EP-2202228-A1 AMIDE COMPOUNDS AND USE OF THE SAME Takeda Pharmaceutical Company Limited (JP) 2010-06-30 — — EP disclosed
EP-2202228-A1 AMIDE COMPOUNDS AND USE OF THE SAME Takeda Pharmaceutical Company Limited (JP) 2010-06-30 — — EP disclosed
EP-1560827-A1 ANTI-INFECTIVE AGENTS Abbott Laboratories (US) 2005-08-10 — — EP disclosed
US-20050075331-A1 Anti-infective agents ABBOTT LABORATORIES 2005-04-07 — — US disclosed
US-20040167123-A1 Anti-infective agents ABBVIE INC. 2004-08-26 — — US disclosed
US-20040162285-A1 Anti-infective agents ABBOTT LABORATORIES 2004-08-19 — — US disclosed
WO-2004041818-A1 ANTI-INFECTIVE AGENTS ABBOTT LABORATORIES (US) 2004-05-21 — — WO disclosed
US-20040097492-A1 Anti-infective agents ABBOTT LABORATORIES 2004-05-20 — — US disclosed
US-20040087577-A1 Anti-infective agents ABBOTT LABORATORIES 2004-05-06 — — 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 (6 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-20040097492-A1 Anti-infective agents POLR1C, RPL5, POLB PPARG 1209/4885THRB 3869/4885RXFP1 4826/4885
US-20130137673-A1 INHIBITORS OF JAK JAK1, JAK2, JAK3 PPARG 2640/4885THRB 1519/4885RXFP1 3923/4885
US-20040162285-A1 Anti-infective agents POLR1C, RPL5, POLB PPARG 1209/4885THRB 3869/4885RXFP1 4826/4885
US-20040167123-A1 Anti-infective agents SERPINB1, CYP51A1, ZC3HAV1 PPARG 2004/4885THRB 4632/4885RXFP1 4401/4885
US-20050075331-A1 Anti-infective agents RPL35, POLI, POLRMT PPARG 1343/4885THRB 4525/4885RXFP1 4727/4885
US-20040087577-A1 Anti-infective agents POLR1C, RPL5, POLB PPARG 1209/4885THRB 3869/4885RXFP1 4826/4885

“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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