SCHEMBL3530493

SCHEMBL3530493

Cc1oc(-c2ccc(-c3ccc(-c4nc(CCO)c(C)o4)cc3)cc2)nc1CCO

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.53
NPC1 O15118 1/20 0.53
KDM4E B2RXH2 2/20 0.51
HRH3 Q9Y5N1 2/20 0.49
PPARG P37231 8/20 0.47
PPARA Q07869 7/20 0.47
TARBP2 Q15633 1/20 0.46
HPGD P15428 2/20 0.44
HSD17B10 Q99714 2/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PPARD Q03181 1/20 0.44
KDM1A O60341 1/20 0.43
KDR P35968 1/20 0.43
TP53 P04637 1/20 0.43

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
SCHEMBL4888378 0.94 RAB9A (0.62) RAB9ANPC1KDM4EHRH3PPARG
SCHEMBL820945 0.93 SMN1; SMN2 (0.51) RAB9ANPC1KDM4EHRH3PPARG
SCHEMBL1436227 0.90 HSD17B10 (0.54) RAB9ANPC1KDM4EPPARGPPARA
SCHEMBL1981068 0.90 PPARG (0.54) RAB9ANPC1KDM4EHRH3PPARG
SCHEMBL1436051 0.90 PPARA (0.51) RAB9ANPC1KDM4EHRH3PPARG
SCHEMBL979145 0.90 KDM4E (0.65) RAB9ANPC1KDM4EHRH3PPARG
SCHEMBL3591143 0.89 RAB9A (0.46) RAB9ANPC1KDM4EHRH3PPARG
SCHEMBL5365528 0.89 KDM4E (0.57) RAB9ANPC1KDM4EPPARGPPARA
SCHEMBL7914489 0.88 KDM4E (0.48) RAB9ANPC1KDM4EHRH3PPARG
SCHEMBL3585584 0.88 KDM4E (0.44) RAB9ANPC1KDM4EHRH3PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7816385-B2 Dimeric dicarboxylic acid derivatives, their preparation and use HIGH POINT PHARMACEUTICALS, LLC (US) 2010-10-19 US disclosed
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 RAB9A 3036/4885NPC1 721/4885KDM4E 3030/4885

“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.