SCHEMBL3539146

SCHEMBL3539146

CN(CCSc1ccc(OCC(=O)O)cc1)c1cccc(N(C)CCSc2ccc(OCC(=O)O)cc2)n1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 4/20 0.43
ALOX15 P16050 1/20 0.42
PTPN7 P35236 2/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42
PTPN12 Q05209 1/20 0.42
MCL1 Q07820 1/20 0.41
PPARG P37231 3/20 0.41
PPARA Q07869 2/20 0.41
PPARD Q03181 3/20 0.40
NPC1 O15118 1/20 0.40
USP2 O75604 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PLA2G4B P0C869 1/20 0.39
PLA2G2A P14555 1/20 0.39
LMNA P02545 1/20 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
SCHEMBL3539140 0.87 NPC1 (0.39) PTPN7MEN1ALDH1A1MAPTKMT2A
SCHEMBL3534597 0.84 PPARD (0.50) PPARGPPARAPPARD
SCHEMBL3532536 0.81 SLC6A4 (0.39) FFAR1ALDH1A1LMNA
SCHEMBL3532524 0.74 PRKAG1 (0.41)
SCHEMBL23355624 0.70 KMT2A (0.41) ALOX15MEN1ALDH1A1KMT2ASMN1; SMN2
SCHEMBL3535428 0.70 PPARG (0.41) MEN1ALDH1A1KMT2APPARGPPARA
SCHEMBL3532533 0.69 MTNR1A (0.33) ALDH1A1MAPTNPC1SMN1; SMN2
SCHEMBL17285627 0.68 ALDH1A1 (0.54) FFAR1ALOX15ALDH1A1PPARDSMN1; SMN2
SCHEMBL4266126 0.68 ALDH1A1 (0.59) ALOX15ALDH1A1MAPTPLA2G4BPLA2G2A
SCHEMBL27650744 0.67 ALOX15 (0.59) FFAR1ALOX15PTPN7MEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1578716-A1 DICARBOXYLIC ACID DERIVATIVES AS PPAR-AGONISTS NOVO NORDISK A/S (DK) 2005-09-28 EP claimed
US-20040259950-A1 Novel compounds, their preparation and use HIGH POINT PHARMACEUTICALS, LLC 2004-12-23 US claimed
WO-2004056740-A1 DICARBOXYLIC ACID DERIVATIVES AS PPAR-AGONISTS NOVO NORDISK A/S (DK) 2004-07-08 WO claimed
US-7816385-B2 Dimeric dicarboxylic acid derivatives, their preparation and use HIGH POINT PHARMACEUTICALS, LLC (US) 2010-10-19 US disclosed
EP-1578716-A1 DICARBOXYLIC ACID DERIVATIVES AS PPAR-AGONISTS NOVO NORDISK A/S (DK) 2005-09-28 EP disclosed
US-20040259950-A1 Novel compounds, their preparation and use HIGH POINT PHARMACEUTICALS, LLC 2004-12-23 US disclosed
WO-2004056740-A1 DICARBOXYLIC ACID DERIVATIVES AS PPAR-AGONISTS NOVO NORDISK A/S (DK) 2004-07-08 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 (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-20040259950-A1 Novel compounds, their preparation and use PPARG, PPARA, PPARD FFAR1 33/4885ALOX15 699/4885PTPN7 3608/4885

“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.