SCHEMBL1263418

SCHEMBL1263418

COC[C@H](C)Oc1cccc(Oc2cccc(C(=O)O)c2)c1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GCK P35557 12/20 0.60
AKR1C3 P42330 1/20 0.58
KMT2A Q03164 1/20 0.51
NPC1 O15118 1/20 0.50
POLB P06746 1/20 0.50
CYP2C9 P11712 1/20 0.50
RAB9A P51151 1/20 0.50
RARG P13631 1/20 0.50
KMO O15229 1/20 0.50
RARA P10276 1/20 0.49
RARB P10826 1/20 0.49

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 0.94 KMT2A (0.56) GCKAKR1C3KMT2ARARARARB
SCHEMBL1263090 0.90 GCK (0.70) GCKAKR1C3RARGRARARARB
SCHEMBL2666225 0.89 GCK (0.56) GCKAKR1C3KMT2ANPC1POLB
SCHEMBL1107704 0.88 GCK (0.68) GCKAKR1C3RARGRARARARB
SCHEMBL1263205 0.86 GCK (0.71) GCKRARGRARARARB
SCHEMBL17933978 0.84 GCK (0.58) GCKRARG
SCHEMBL1107734 0.84 GCK (0.57) GCKRARGRARARARB
SCHEMBL9891691 0.82 MAOB (0.50) GCKKMT2ANPC1RAB9A
SCHEMBL1263473 0.82 KMT2A (0.54) GCKKMT2ARARARARB
SCHEMBL1107687 0.81 SMN1; SMN2 (0.49) GCKKMT2ANPC1POLBCYP2C9

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 GCK 1/4885AKR1C3 1570/4885KMT2A 1445/4885
US-20110230529-A1 BENZAMIDE GLUCOKINASE ACTIVATORS GCK, GCKR, KHK GCK 1/4885AKR1C3 1570/4885KMT2A 1445/4885

“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.