SCHEMBL2701890

SCHEMBL2701890

NC(=O)c1ccn(C[C@H](O)CO)n1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADA P00813 3/20 0.35
SCN9A Q15858 5/20 0.33
CSNK2A1 P68400 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 2/20 0.32
KDM4C Q9H3R0 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
TGFBR1 P36897 2/20 0.31
MEN1 O00255 1/20 0.31
FAAH O00519 1/20 0.31
AHCY P23526 1/20 0.31
ADORA2A P29274 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
SCHEMBL1082327 1.00 ADA (0.35) ADASCN9ACSNK2A1SMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL1082147 0.98 ADA (0.34) ADASCN9ACSNK2A1SMN1; SMN2ALDH1A1
SCHEMBL28666209 0.84 ADA (0.33) ADASCN9ASMN1; SMN2ALDH1A1KMT2A
SCHEMBL2660631 0.84 LTA4H (0.37) ADASCN9ASMN1; SMN2ALDH1A1KMT2A
SCHEMBL3373849 0.82 DNM1 (0.39) SMN1; SMN2ALDH1A1KMT2AKDM4CCYP1A2
SCHEMBL22235117 0.80 CA5A (0.37) SCN9ASMN1; SMN2ALDH1A1KMT2AKDM4C
SCHEMBL12862631 0.80 ALDH1A1 (0.37) SMN1; SMN2ALDH1A1KMT2AKDM4CCYP1A2
SCHEMBL2660914 0.80 TSHR (0.42) SMN1; SMN2ALDH1A1KMT2ACYP1A2CYP2D6
Hydrochloric Acid SCHEMBL30520116 0.79 CA5A (0.36) SCN9ASMN1; SMN2ALDH1A1KMT2AKDM4C
SCHEMBL1080403 0.76 ALDH1A1 (0.40) CSNK2A1ALDH1A1KMT2AMEN1AHCY

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2274297-B1 PYRROLIDINONE GLUCOKINASE ACTIVATORS HOFFMANN LA ROCHE (CH) 2012-05-09 EP claimed
US-7741327-B2 Pyrrolidinone glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2010-06-22 US claimed
US-20090264445-A1 PYRROLIDINONE GLUCOKINASE ACTIVATORS BERTHEL STEVEN JOSEPH 2009-10-22 US claimed
EP-2274297-B1 PYRROLIDINONE GLUCOKINASE ACTIVATORS HOFFMANN LA ROCHE (CH) 2012-05-09 EP disclosed
US-7741327-B2 Pyrrolidinone glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2010-06-22 US disclosed
US-20090264445-A1 PYRROLIDINONE GLUCOKINASE ACTIVATORS BERTHEL STEVEN JOSEPH 2009-10-22 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 (1 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-20090264445-A1 PYRROLIDINONE GLUCOKINASE ACTIVATORS GCKR, GCK, PDK2 ADA 393/4885SCN9A 3497/4885CSNK2A1 598/4885

“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.