SCHEMBL1711904

SCHEMBL1711904

O=C(O)C(O)CC1CCCO1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HPGD P15428 5/20 0.45
TP53 P04637 1/20 0.45
ALOX12 P18054 1/20 0.45
ALDH1A1 P00352 2/20 0.44
LMNA P02545 2/20 0.42
POLB P06746 1/20 0.42
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
PKM P14618 1/20 0.40
CYP2C19 P33261 1/20 0.40
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
KDM4E B2RXH2 2/20 0.38

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
SCHEMBL1711900 1.00 USP2 (0.46) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL1711899 1.00 USP2 (0.46) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL4888352 0.94 USP2 (0.41) USP2SMN1; SMN2HPGDTP53ALOX12
Acetonitrile SCHEMBL27943294 0.89 USP2 (0.39) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL11864950 0.84 USP2 (0.49) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL8171662 0.82 USP2 (0.41) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL7888410 0.79 USP2 (0.45) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL1711638 0.79 USP2 (0.45) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL7880579 0.79 USP2 (0.45) USP2SMN1; SMN2HPGDTP53ALOX12
SCHEMBL7887892 0.79 USP2 (0.45) USP2SMN1; SMN2HPGDTP53ALOX12

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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-20110230445-A1 Substituted Heteroaryls PFIZER INC 2011-09-22 US disclosed
EP-2344458-A1 HETEROARYLS AMIDE DERIVATIVES AND THEIR USE AS GLUCOKINASE ACTIVATORS Pfizer Inc. (US) 2011-07-20 EP disclosed
US-7977367-B2 Substituted imidazole propanamide glucokinase activators PFIZER INC (US) 2011-07-12 US 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 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-20120225910-A1 Substituted Heteroaryls GCKR, GCK, GALK1 USP2 3617/4885SMN1; SMN2 3399/4885HPGD 2060/4885
US-20110230445-A1 Substituted Heteroaryls GCKR, GCK, GALK1 USP2 3587/4885SMN1; SMN2 3447/4885HPGD 2200/4885
US-20100063063-A1 Substituted Heteroaryls GCKR, GCK, GALK1 USP2 3587/4885SMN1; SMN2 3447/4885HPGD 2200/4885
US-20130165452-A1 Substituted Heteroaryls GCKR, GCK, GALK1 USP2 3587/4885SMN1; SMN2 3447/4885HPGD 2200/4885

“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.