SCHEMBL1107544

SCHEMBL1107544

O=C1NC[C@H](C(=O)OCc2ccccc2)O1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.55
GLA P06280 1/20 0.44
TSHR P16473 1/20 0.44
HTR2C P28335 1/20 0.44
FABP7 O15540 1/20 0.43
FABP5 Q01469 1/20 0.43
ELANE P08246 1/20 0.43
ALDH1A1 P00352 3/20 0.42
NAAA Q02083 1/20 0.42
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
GAA P10253 1/20 0.41
PKM P14618 1/20 0.41

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
SCHEMBL18603259 1.00 LMNA (0.55) LMNAGLATSHRHTR2CFABP7
SCHEMBL12741664 1.00 LMNA (0.55) LMNAGLATSHRHTR2CFABP7
SCHEMBL8466630 0.79 ELANE (0.49) TSHRFABP7FABP5ELANEALDH1A1
SCHEMBL16648788 0.77 ALDH1A1 (0.52) LMNATSHRFABP7FABP5ALDH1A1
SCHEMBL19749101 0.77 ALDH1A1 (0.52) LMNATSHRFABP7FABP5ALDH1A1
SCHEMBL29433900 0.77 ALDH1A1 (0.52) LMNATSHRFABP7FABP5ALDH1A1
SCHEMBL20253575 0.77 FABP7 (0.46) TSHRFABP7FABP5ELANEALDH1A1
SCHEMBL16938624 0.75 TSHR (0.51) GLATSHRHTR2CFABP7FABP5
SCHEMBL5310196 0.75 TSHR (0.51) GLATSHRHTR2CFABP7FABP5
Bicarbonate SCHEMBL29739771 0.75 ALDH1A1 (0.50) LMNATSHRFABP7FABP5ALDH1A1

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11459336-B2 Pyrazine carbamates and their use as GluN2B receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2022-10-04 US disclosed
EP-3983072-A1 PYRAZINE CARBAMATES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2022-04-20 EP disclosed
CN-108026080-B Pyrazolyl-substituted heteroaryl compounds and their use as medicaments 勃林格殷格翰国际有限公司 2021-06-11 CN disclosed
US-10590154-B2 Method for preparing oxazolidinone intermediate ZHEJIANG HUAHAI PHARMACEUTICAL CO., LTD (CN) 2020-03-17 US disclosed
EP-3347353-B1 PYRAZOLYL-SUBSTITUTED HETEROARYLS AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INT (DE) 2019-07-17 EP disclosed
US-10155751-B2 Pyrazolyl-substituted heteroaryls and their use as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2018-12-18 US disclosed
EP-3347353-A1 PYRAZOLYL-SUBSTITUTED HETEROARYLS AND THEIR USE AS MEDICAMENTS Boehringer Ingelheim International GmbH (DE) 2018-07-18 EP disclosed
US-20180148433-A1 New Pyrazolyl-substituted Heteroaryls and their use as Medicaments BOEHRINGER INGELHEIM INT (DE) 2018-05-31 US disclosed
US-9845314-B2 Pyrazolyl-substituted heteroaryls and their use as medicaments BOEHRNGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-12-19 US disclosed
US-9845314-B2 Pyrazolyl-substituted heteroaryls and their use as medicaments BOEHRNGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-12-19 US disclosed
US-20120142636-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2012-06-07 US disclosed
US-8153677-B2 Substituted pyrazolylamide compounds useful as glucokinase activators BRISTOL-MYERS SQUIBB COMPANY (US) 2012-04-10 US disclosed
US-8153677-B2 Substituted pyrazolylamide compounds useful as glucokinase activators BRISTOL-MYERS SQUIBB COMPANY (US) 2012-04-10 US disclosed
US-20110118211-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2011-05-19 US disclosed
US-20110118211-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2011-05-19 US disclosed
US-7910747-B2 Phosphonate and phosphinate pyrazolylamide glucokinase activators BRISTOL-MYERS SQUIBB COMPANY (US) 2011-03-22 US disclosed
US-7910747-B2 Phosphonate and phosphinate pyrazolylamide glucokinase activators BRISTOL-MYERS SQUIBB COMPANY (US) 2011-03-22 US disclosed
US-20080009465-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2008-01-10 US disclosed
WO-2008005964-A2 PHOSPHONATE AND PHOSPHINATE COMPOUNDS AS GLUCOKINASE ACTIVATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-01-10 WO disclosed
US-20080009465-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2008-01-10 US 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 (7 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-20110118211-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME GCKR, MPO, GCK LMNA 4827/4885GLA 770/4885TSHR 787/4885
US-10155751-B2 Pyrazolyl-substituted heteroaryls and their use as medicaments HRH4, HRH3, HRH1 LMNA 1651/4885GLA 1296/4885TSHR 568/4885
US-20180148433-A1 New Pyrazolyl-substituted Heteroaryls and their use as Medicaments HRH4, HRH2, HRH3 LMNA 2332/4885GLA 1245/4885TSHR 626/4885
US-10590154-B2 Method for preparing oxazolidinone intermediate LDHA, SORD, LDHB LMNA 2369/4885GLA 1672/4885TSHR 3692/4885
US-20080009465-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME GCKR, GCK, PCK1 LMNA 4811/4885GLA 395/4885TSHR 841/4885
US-20120142636-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME GCKR, GCK, PCK1 LMNA 4815/4885GLA 651/4885TSHR 892/4885
US-11459336-B2 Pyrazine carbamates and their use as GluN2B receptor modulators GRIN2B, GRIN2A, GRIN2C LMNA 4417/4885GLA 2648/4885TSHR 445/4885

“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.