SCHEMBL2032946

SCHEMBL2032946

N#Cc1ccc2nc(Sc3c(Cl)cc(NS(=O)(=O)c4ccc(C(F)(F)F)cc4Cl)cc3Cl)sc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 5/20 0.44
CYP3A4 P08684 2/20 0.44
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
ALDH1A1 P00352 3/20 0.40
LMNA P02545 3/20 0.40
HPGD P15428 3/20 0.40
THRB P10828 1/20 0.40
CSNK1D P48730 1/20 0.39
CSNK1G2 P78368 1/20 0.39
PPARA Q07869 4/20 0.38
GPR6 P46095 1/20 0.38
MAPT P10636 3/20 0.38
PKM P14618 2/20 0.38
PPARD Q03181 3/20 0.38
HTT P42858 2/20 0.37
KDM4E B2RXH2 1/20 0.37
SLC22A12 Q96S37 2/20 0.37
SGK1 O00141 1/20 0.37
CTSD P07339 1/20 0.37

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
SCHEMBL2033340 0.93 CYP3A4 (0.44) PPARGCYP3A4MEN1KMT2AALDH1A1
SCHEMBL2029413 0.90 MEN1 (0.43) PPARGCYP3A4MEN1KMT2AALDH1A1
SCHEMBL2028011 0.89 PPARG (0.48) PPARGCYP3A4MEN1KMT2AALDH1A1
SCHEMBL12670834 0.87 ALDH1A1 (0.46) PPARGCYP3A4MEN1KMT2AALDH1A1
SCHEMBL2036572 0.86 CYP3A4 (0.49) PPARGCYP3A4MEN1KMT2AALDH1A1
SCHEMBL2030764 0.84 PPARG (0.43) PPARGCYP3A4MEN1KMT2AALDH1A1
SCHEMBL2031022 0.83 MAPT (0.42) PPARGCYP3A4MEN1KMT2AALDH1A1
SCHEMBL2031128 0.81 PPARG (0.48) PPARGCYP3A4MEN1KMT2AALDH1A1
SCHEMBL2033632 0.81 PPARG (0.45) PPARGCYP3A4MEN1KMT2AALDH1A1
SCHEMBL2028920 0.81 PPARG (0.42) PPARGCYP3A4MEN1KMT2AALDH1A1

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 PPARG 1/4885CYP3A4 1649/4885MEN1 4082/4885
US-20060264481-A1 Therapeutic modulation of PPARgamma activity PPARG, PPARA, PPARD PPARG 1/4885CYP3A4 1649/4885MEN1 4082/4885
US-20030139390-A1 Compounds for the modulation of PPARgamma activity PPARG, PPARA, PPARD PPARG 1/4885CYP3A4 1153/4885MEN1 4867/4885
US-20100113522-A1 COMPOUNDS FOR THE MODULATION OF PPARgamma ACTIVITY PPARG, PPARA, PPARD PPARG 1/4885CYP3A4 1165/4885MEN1 4871/4885
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 PPARG 2/4885CYP3A4 167/4885MEN1 4881/4885

“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.