SCHEMBL1711540

SCHEMBL1711540

O=C(O)[C@H](O)CC1CCOCC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OR51E2 Q9H255 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.34
CPN1 P15169 1/20 0.34
CPB2 Q96IY4 1/20 0.34
PIK3CD O00329 1/20 0.33
TET2 Q6N021 3/20 0.32
KDM4A O75164 2/20 0.32
KDM4C Q9H3R0 2/20 0.32
KDM2A Q9Y2K7 2/20 0.32
TET3 O43151 1/20 0.32
ALDH1A1 P00352 1/20 0.32
ANPEP P15144 2/20 0.31
ENPEP Q07075 2/20 0.31
GCK P35557 1/20 0.30
CTSD P07339 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
SCHEMBL1711544 1.00 OR51E2 (0.36) OR51E2SMN1; SMN2CPN1CPB2PIK3CD
SCHEMBL7302529 0.84
SCHEMBL7302534 0.84
SCHEMBL10890162 0.84 OR51E2 (0.43) OR51E2SMN1; SMN2CPN1CPB2TET2
SCHEMBL7488763 0.84
SCHEMBL7495280 0.80 SLC1A3 (0.40) OR51E2SMN1; SMN2CPN1CPB2TET2
SCHEMBL3346213 0.80 SLC1A3 (0.40) OR51E2SMN1; SMN2CPN1CPB2TET2
SCHEMBL1931748 0.80 SLC1A3 (0.40) OR51E2SMN1; SMN2
SCHEMBL3353915 0.80 SLC1A3 (0.40) OR51E2SMN1; SMN2
SCHEMBL1931750 0.80 SLC1A3 (0.40) OR51E2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130165452-A1 Substituted Heteroaryls PFIZER INC. (US) 2013-06-27 US disclosed
US-20130165452-A1 Substituted Heteroaryls PFIZER INC. (US) 2013-06-27 US disclosed
US-20130165452-A1 Substituted Heteroaryls PFIZER INC. (US) 2013-06-27 US disclosed
US-8389552-B2 (S)-6-(2-(4-(cyclobutylsulfonyl)-1H-imidazol-1-yl)-3-cyclopentylpropanamido)nicotinic acid useful as a glucokinase activator PFIZER INC. (US) 2013-03-05 US disclosed
US-8389552-B2 (S)-6-(2-(4-(cyclobutylsulfonyl)-1H-imidazol-1-yl)-3-cyclopentylpropanamido)nicotinic acid useful as a glucokinase activator PFIZER INC. (US) 2013-03-05 US disclosed
US-8389552-B2 (S)-6-(2-(4-(cyclobutylsulfonyl)-1H-imidazol-1-yl)-3-cyclopentylpropanamido)nicotinic acid useful as a glucokinase activator PFIZER INC. (US) 2013-03-05 US disclosed
US-8329920-B2 Substituted imidazoles useful for treating type II diabetes PFIZER INC. (US) 2012-12-11 US disclosed
US-8329920-B2 Substituted imidazoles useful for treating type II diabetes PFIZER INC. (US) 2012-12-11 US disclosed
US-8329920-B2 Substituted imidazoles useful for treating type II diabetes PFIZER INC. (US) 2012-12-11 US disclosed
US-20120225910-A1 Substituted Heteroaryls PFIZER INC. (US) 2012-09-06 US disclosed
US-20110130365-A1 Fluorinated Heteroaryls BENBOW JOHN W 2011-06-02 US disclosed
US-20110130365-A1 Fluorinated Heteroaryls BENBOW JOHN W 2011-06-02 US disclosed
US-20110130365-A1 Fluorinated Heteroaryls BENBOW JOHN W 2011-06-02 US disclosed
US-20100184777-A1 Substituted Pyrazinone Amides PFIZER INC 2010-07-22 US disclosed
US-20100184777-A1 Substituted Pyrazinone Amides PFIZER INC 2010-07-22 US disclosed
US-20100184777-A1 Substituted Pyrazinone Amides PFIZER INC 2010-07-22 US disclosed
WO-2010029461-A1 HETEROARYLS AMIDE DERIVATIVES AND THEIR USE AS GLUCOKINASE ACTIVATORS PFIZER INC. (US) 2010-03-18 WO disclosed
WO-2010029461-A1 HETEROARYLS AMIDE DERIVATIVES AND THEIR USE AS GLUCOKINASE ACTIVATORS PFIZER INC. (US) 2010-03-18 WO disclosed
US-20100063063-A1 Substituted Heteroaryls PFIZER INC 2010-03-11 US disclosed
US-20100063063-A1 Substituted Heteroaryls PFIZER INC 2010-03-11 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 (5 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-20100184777-A1 Substituted Pyrazinone Amides GCK, GCKR, PDK2 OR51E2 4809/4885SMN1; SMN2 4002/4885CPN1 2275/4885
US-20110130365-A1 Fluorinated Heteroaryls GCKR, GALK1, GCK OR51E2 4826/4885SMN1; SMN2 2551/4885CPN1 2809/4885
US-20120225910-A1 Substituted Heteroaryls GCKR, GCK, GALK1 OR51E2 4878/4885SMN1; SMN2 3399/4885CPN1 2908/4885
US-20100063063-A1 Substituted Heteroaryls GCKR, GCK, GALK1 OR51E2 4877/4885SMN1; SMN2 3447/4885CPN1 2931/4885
US-20130165452-A1 Substituted Heteroaryls GCKR, GCK, GALK1 OR51E2 4877/4885SMN1; SMN2 3447/4885CPN1 2931/4885

“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.