SCHEMBL2029413

SCHEMBL2029413

N#Cc1ccc2nc(Sc3ccc(NS(=O)(=O)c4ccc(C(F)(F)F)cc4Cl)cc3Cl)sc2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.43
KMT2A Q03164 6/20 0.43
LMNA P02545 5/20 0.43
ALDH1A1 P00352 4/20 0.43
HPGD P15428 3/20 0.43
THRB P10828 1/20 0.43
MAPT P10636 6/20 0.42
GAA P10253 4/20 0.42
POLB P06746 1/20 0.42
PPARG P37231 4/20 0.41
TP53 P04637 2/20 0.41
CYP3A4 P08684 1/20 0.41
PKM P14618 2/20 0.41
CSNK1D P48730 1/20 0.40
CSNK1G2 P78368 1/20 0.40
KDM4E B2RXH2 2/20 0.40
HTT P42858 2/20 0.40
PPARD Q03181 3/20 0.40
PPARA Q07869 3/20 0.40
NPSR1 Q6W5P4 2/20 0.39

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
SCHEMBL2031022 0.93 MAPT (0.42) MEN1KMT2ALMNAALDH1A1HPGD
SCHEMBL2032946 0.90 PPARG (0.44) MEN1KMT2ALMNAALDH1A1HPGD
SCHEMBL2033158 0.89 MAPT (0.51) MEN1KMT2ALMNAALDH1A1HPGD
SCHEMBL12670833 0.87 MEN1 (0.49) MEN1KMT2ALMNAALDH1A1HPGD
SCHEMBL12670163 0.86 GAA (0.56) MEN1KMT2ALMNAALDH1A1HPGD
SCHEMBL2036273 0.86 MAPT (0.47) MEN1KMT2ALMNAALDH1A1HPGD
SCHEMBL2034239 0.85 MAPT (0.44) MEN1KMT2ALMNAALDH1A1HPGD
SCHEMBL2742720 0.84 MAPT (0.51) MEN1KMT2ALMNAALDH1A1HPGD
SCHEMBL2033340 0.83 CYP3A4 (0.44) MEN1KMT2ALMNAALDH1A1HPGD
SCHEMBL2030411 0.82 MAPT (0.51) MEN1KMT2ALMNAALDH1A1HPGD

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 13 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
EP-1192137-A1 COMPOUNDS FOR THE MODULATION OF PPAR$g(g) ACTIVITY Tularik Inc. (US) 2002-04-03 EP disclosed
WO-2001000579-A1 COMPOUNDS FOR THE MODULATION OF PPARη ACTIVITY TULARIK INC. (US) 2001-01-04 WO 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 MEN1 4082/4885KMT2A 3800/4885LMNA 3018/4885
US-20060264481-A1 Therapeutic modulation of PPARgamma activity PPARG, PPARA, PPARD MEN1 4082/4885KMT2A 3800/4885LMNA 3018/4885
US-20030139390-A1 Compounds for the modulation of PPARgamma activity PPARG, PPARA, PPARD MEN1 4867/4885KMT2A 4027/4885LMNA 1880/4885
US-20100113522-A1 COMPOUNDS FOR THE MODULATION OF PPARgamma ACTIVITY PPARG, PPARA, PPARD MEN1 4871/4885KMT2A 3971/4885LMNA 1978/4885
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 MEN1 4881/4885KMT2A 1896/4885LMNA 4462/4885

“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.