SCHEMBL3211484

SCHEMBL3211484

CCCCOc1cc(C(=O)O)n(Cc2ccc(Cl)cc2Cl)n1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.60
PPARG P37231 12/20 0.58
CYP1A2 P05177 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
TSHR P16473 1/20 0.47
PMP22 Q01453 1/20 0.47
HIF1A Q16665 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
PTGER1 P34995 2/20 0.46
SLC16A3 O15427 1/20 0.44
SLC16A1 P53985 1/20 0.44
MCTS1 Q9ULC4 1/20 0.44

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
SCHEMBL3204492 0.89 PPARG (0.56) NPC1PPARGSLC16A3SLC16A1MCTS1
SCHEMBL3207320 0.89 PPARG (0.58) NPC1PPARG
SCHEMBL4531225 0.87 PPARG (0.54) NPC1PPARGSLC16A3SLC16A1MCTS1
SCHEMBL3220169 0.86 PPARG (0.49) NPC1PPARG
SCHEMBL3204908 0.86 PPARG (0.53) NPC1PPARG
SCHEMBL3216072 0.85 PPARG (0.63) NPC1PPARGSLC16A3SLC16A1MCTS1
SCHEMBL3217226 0.83 PPARG (0.71) PPARG
SCHEMBL3215716 0.83 PPARG (0.71) PPARG
SCHEMBL4615895 0.83 PPARG (0.56) NPC1PPARGSLC16A3SLC16A1MCTS1
SCHEMBL3204500 0.82 PPARG (0.58) NPC1PPARG

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-20100041892-A1 Therapeutic agent for diabetes ABE HIDENORI 2010-02-18 US disclosed
US-20090270631-A1 Therapeutic agent for diabetes ABE HIDENORI 2009-10-29 US disclosed
EP-1912645-A2 THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2008-04-23 EP disclosed
US-20080009530-A1 Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-10 US disclosed
WO-2007018314-A2 THERAPEUTIC AGENT FOR DIABETES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-15 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 (3 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-20090270631-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 NPC1 1683/4885PPARG 31/4885CYP1A2 2418/4885
US-20080009530-A1 Therapeutic Agent for Diabetes FABP4, SLC5A1, SLC5A2 NPC1 1377/4885PPARG 30/4885CYP1A2 1645/4885
US-20100041892-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 NPC1 1683/4885PPARG 31/4885CYP1A2 2418/4885

“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.