SCHEMBL1263473

SCHEMBL1263473

COC[C@H](C)Oc1cccc(CCOc2cccc(C(=O)O)c2)c1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.54
NR4A2 P43354 5/20 0.51
GCK P35557 6/20 0.49
RARA P10276 1/20 0.49
RARB P10826 1/20 0.49
MRGPRX4 Q96LA9 1/20 0.49
NR1H4 Q96RI1 3/20 0.47
LPAR1 Q92633 1/20 0.46
PLA2G4B P0C869 1/20 0.46

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
SCHEMBL1107670 0.87 KMT2A (0.56) KMT2ANR4A2GCKRARARARB
SCHEMBL1107666 0.84 GCK (0.58) KMT2AGCKRARARARB
SCHEMBL1107676 0.83 GCK (0.54) NR4A2GCKRARARARB
SCHEMBL1263418 0.82 GCK (0.60) KMT2AGCKRARARARB
SCHEMBL30869931 0.80 NR4A2 (0.71) KMT2ANR4A2MRGPRX4NR1H4LPAR1
SCHEMBL1168167 0.80 NR4A2 (0.71) KMT2ANR4A2MRGPRX4NR1H4LPAR1
SCHEMBL12742914 0.79 PTGES (0.52) GCKRARARARB
SCHEMBL1107732 0.78 GCK (0.53) GCKRARARARB
SCHEMBL1107714 0.78 GCK (0.61) GCKRARARARB
SCHEMBL9374246 0.78 KMT2A (0.59) KMT2ANR4A2NR1H4PLA2G4B

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-20110230529-A1 BENZAMIDE GLUCOKINASE ACTIVATORS TRANSTECH PHARMA, INC. (US) 2011-09-22 US disclosed
US-7880012-B2 e.g. 3-[2-(3-Isopropoxy-5-phenoxy-benzoylamino)-thiazol-5-yl-sulfanyl]-propionic acid methyl ester; metabolic disorder, blood glucose lowering, hyperglycemia, impaired glucose tolerance (IGT), Syndrome X, Polycystic Ovarian Syndrome, type I and type II diabetes, dyslipidemia, hyperlipidemia etc. TRANSTECH PHARMA, INC. (US) 2011-02-01 US disclosed
US-20090176991-A1 BENZAMIDE GLUCOKINASE ACTIVATORS TRANSTECH PHARMA, LLC 2009-07-09 US disclosed
EP-2019824-A2 BENZAMIDE GLUCOKINASE ACTIVATORS Transtech Pharma, Inc. (US) 2009-02-04 EP disclosed
WO-2007125103-A2 BENZAMIDE GLUCOKINASE ACTIVATORS TRANSTECH PHARMA, INC. (US) 2007-11-08 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 (2 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-20090176991-A1 BENZAMIDE GLUCOKINASE ACTIVATORS GCK, GCKR, KHK KMT2A 1445/4885NR4A2 2618/4885GCK 1/4885
US-20110230529-A1 BENZAMIDE GLUCOKINASE ACTIVATORS GCK, GCKR, KHK KMT2A 1445/4885NR4A2 2618/4885GCK 1/4885

“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.