SCHEMBL3258251

SCHEMBL3258251

CCOC(CC)(CC)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 1/20 0.36
ALDH1A1 P00352 4/20 0.33
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
THRB P10828 1/20 0.32
KMT2A Q03164 1/20 0.32
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
FFAR3 O14843 1/20 0.32
ALOX15 P16050 1/20 0.31
MGAM O43451 1/20 0.31
GAA P10253 1/20 0.31
SI P14410 1/20 0.31
MGAM2 Q2M2H8 1/20 0.31
TSHR P16473 1/20 0.30
HCAR2 Q8TDS4 1/20 0.30

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
SCHEMBL28324952 0.97 SOAT1 (0.35) SOAT1ALDH1A1MEN1CYP1A2THRB
SCHEMBL1670467 0.86 MEN1 (0.32) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL315985 0.86 CYP2D6 (0.39) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL5346342 0.86 CYP2D6 (0.39) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL3871051 0.83 PAM (0.32) ALDH1A1MEN1KMT2APPARGPPARA
SCHEMBL28427067 0.80 FFAR3 (0.35) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL4329618 0.80 CYP2D6 (0.42) ALDH1A1FFAR3TSHR
SCHEMBL27375963 0.80 ALDH1A1 (0.40) ALDH1A1MEN1CYP1A2THRBKMT2A
SCHEMBL28634076 0.80 MEN1 (0.39) ALDH1A1MEN1KMT2APPARGPPARA
SCHEMBL24780286 0.77 SOAT1 (0.35) SOAT1ALDH1A1LMNAHSD17B10FFAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160362378-A1 MCT4 INHIBITORS FOR TREATING DISEASE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-12-15 US disclosed
EP-1940840-B1 6-HETEROARYLPYRIDOINDOLONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2010-07-21 EP disclosed
EP-1940840-A1 6-HETEROARYLPYRIDOINDOLONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF Sanofi-Aventis (FR) 2008-07-09 EP disclosed
WO-2007045758-A1 6-HETEROARYLPYRIDOINDOLONE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC USE THEREOF SANOFI AVENTIS (FR) 2007-04-26 WO disclosed
US-5491167-A INHIBITORS OF CHOLESTEROL BIOSYNTHESIS SANKYO COMPANY, LIMITED (JP) 1996-02-13 US disclosed
EP-0609058-A2 Hexahydronaphthalene ester derivatives, their preparation and their therapeutic uses SANKYO COMPANY LIMITED (JP) 1994-08-03 EP 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-20160362378-A1 MCT4 INHIBITORS FOR TREATING DISEASE SLC16A3, SLC16A1, MCTS1 SOAT1 1385/4885ALDH1A1 1021/4885MEN1 1340/4885

“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.