SCHEMBL2031349

SCHEMBL2031349

CC(=O)c1cc(N)cc(Cl)c1Sc1nc2cc(C(F)(F)F)ccc2s1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 2/20 0.46
▸ ALOX5 P09917 1/20 0.45
▸ AGPAT2 O15120 3/20 0.41
▸ PPARA Q07869 5/20 0.41
▸ CTSD P07339 3/20 0.39
▸ NCS1 P62166 1/20 0.39
▸ ILK Q13418 2/20 0.38
▸ AKR1B1 P15121 2/20 0.36
▸ ALOX5AP P20292 1/20 0.35

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
SCHEMBL2030702 0.87 ILK (0.44) DYRK1AALOX5AGPAT2PPARACTSD
SCHEMBL2034875 0.86 PPARA (0.49) ALOX5PPARACTSD
SCHEMBL2030012 0.85 DYRK1A (0.42) DYRK1AALOX5PPARACTSD
SCHEMBL2032129 0.85 ALOX5 (0.44) DYRK1AALOX5AGPAT2PPARACTSD
SCHEMBL2030448 0.80 PPARG (0.45) DYRK1AALOX5AGPAT2PPARACTSD
SCHEMBL7576875 0.80 ALOX5 (0.41) DYRK1AALOX5AGPAT2PPARAILK
SCHEMBL2034408 0.78 PPARG (0.46) DYRK1AALOX5AGPAT2PPARACTSD
SCHEMBL2037674 0.77 PPARG (0.44) PPARACTSD
SCHEMBL2035992 0.76 ILK (0.42) DYRK1AALOX5AGPAT2PPARACTSD
SCHEMBL2038330 0.76 PPARG (0.43) DYRK1AALOX5AGPAT2PPARACTSD

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7968567-B2 Compounds for the modulation of PPARγ activity AMGEN INC. (US) 2011-06-28 — — US disclosed
US-20100113522-A1 COMPOUNDS FOR THE MODULATION OF PPARgamma ACTIVITY AMGEN INC. (US) 2010-05-06 — — US disclosed
US-7626033-B2 Compounds for the modulation of PPARγ activity AMGEN INC. (US) 2009-12-01 — — US disclosed
US-20060264481-A1 Therapeutic modulation of PPARgamma activity AMGEN INC. (US) 2006-11-23 — — US disclosed
EP-1722789-A2 THERAPEUTIC MODULATION OF PPAR (GAMMA) ACTIVITY Amgen Inc. (US) 2006-11-22 — — EP disclosed
US-7041691-B1 Compounds for the modulation of PPARγ activity AMGEN INC. (US) 2006-05-09 — — US disclosed
US-20050250820-A1 Therapeutic modulation of PPARgamma activity AMGEN INC. (US) 2005-11-10 — — US disclosed
WO-2005086904-A2 THERAPEUTIC MODULATION OF PPAR (GAMMA) ACTIVITY AMGEN INC. (US) 2005-09-22 — — WO disclosed
US-20040248882-A1 Noninsulin dependent diabetes, obesity, hypercholesterolemia, inflammatory disorders; reduced side effects; such as 5-(4-acetylbenzenesulfonamido-2-fluorophenoxy)-3-chloropyridine TULARIK INC. 2004-12-09 — — US disclosed
US-6770648-B2 ANTIDIABETIC AGENTS TULARIK INC. 2004-08-03 — — US disclosed
US-20030139390-A1 Compounds for the modulation of PPARgamma activity TULARIK INC. 2003-07-24 — — 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 (5 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-20050250820-A1 Therapeutic modulation of PPARgamma activity PPARG, PPARA, PPARD DYRK1A 3986/4885ALOX5 339/4885AGPAT2 825/4885
US-20060264481-A1 Therapeutic modulation of PPARgamma activity PPARG, PPARA, PPARD DYRK1A 3986/4885ALOX5 339/4885AGPAT2 825/4885
US-20030139390-A1 Compounds for the modulation of PPARgamma activity PPARG, PPARA, PPARD DYRK1A 4345/4885ALOX5 643/4885AGPAT2 812/4885
US-20100113522-A1 COMPOUNDS FOR THE MODULATION OF PPARgamma ACTIVITY PPARG, PPARA, PPARD DYRK1A 4351/4885ALOX5 609/4885AGPAT2 860/4885
US-20040248882-A1 Noninsulin dependent diabetes, obesity, hypercholesterolemia, inflammatory disorders; reduced side effects; such as 5-(4-acetylbenzenesulfonamido-2-fluorophenoxy)-3-chloropyridine PPARD, PPARG, PPARA DYRK1A 4359/4885ALOX5 764/4885AGPAT2 524/4885

“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.

Send feedback