SCHEMBL1107557

SCHEMBL1107557

CCOP(C)(=O)Cn1nc(C)cc1N

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.41
L3MBTL1 Q9Y468 1/20 0.38
ALDH1A1 P00352 4/20 0.33
TSHR P16473 3/20 0.33
MAPT P10636 3/20 0.33
MAPK1 P28482 2/20 0.33
GAA P10253 1/20 0.33
LMNA P02545 3/20 0.32
KDM4E B2RXH2 2/20 0.32
PKM P14618 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
GLA P06280 1/20 0.31

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
SCHEMBL1137733 0.86 POLB (0.42) POLBL3MBTL1ALDH1A1TSHRMAPT
SCHEMBL583517 0.70
SCHEMBL15656246 0.69 ALDH1A1 (0.61) POLBALDH1A1TSHRMAPK1LMNA
SCHEMBL21960884 0.68 POLB (0.45) POLBL3MBTL1ALDH1A1TSHRMAPT
SCHEMBL12289421 0.68 ALDH1A1 (0.37) L3MBTL1ALDH1A1TSHR
SCHEMBL1107517 0.68 ALDH1A1 (0.37) L3MBTL1ALDH1A1TSHR
Hydrochloric Acid SCHEMBL21847655 0.68 ALDH1A1 (0.60) POLBALDH1A1TSHRMAPK1LMNA
SCHEMBL1107573 0.68 ALDH1A1 (0.37) L3MBTL1ALDH1A1TSHR
SCHEMBL691318 0.68 POLB (0.51) POLBL3MBTL1ALDH1A1MAPTMAPK1
SCHEMBL11697399 0.67 L3MBTL1 (0.47) POLBL3MBTL1ALDH1A1MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20110118211-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME BRISTOL-MYERS SQUIBB COMPANY 2011-05-19 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 (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-20110118211-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME GCKR, MPO, GCK POLB 1769/4885L3MBTL1 3077/4885ALDH1A1 4045/4885
US-20120142636-A1 NOVEL GLUCOKINASE ACTIVATORS AND METHODS OF USING SAME GCKR, GCK, PCK1 POLB 2797/4885L3MBTL1 2631/4885ALDH1A1 4539/4885

“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.