SCHEMBL2652097

SCHEMBL2652097

O=C(O)CCNC(=O)c1ccc(F)c([N+](=O)[O-])c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GCG P01275 1/20 0.59
SMN1; SMN2 Q16637 4/20 0.51
SIRT5 Q9NXA8 1/20 0.51
AKR1C2 P52895 1/20 0.51
AKR1C1 Q04828 1/20 0.51
ALDH1A1 P00352 3/20 0.49
MAPT P10636 3/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
MAPK1 P28482 1/20 0.48
HSP90AA1 P07900 1/20 0.48
HPGD P15428 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
THRA P10827 2/20 0.47
VDR P11473 1/20 0.47
LMNA P02545 3/20 0.47

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
SCHEMBL3991311 0.86 CYP1A2 (0.53) SMN1; SMN2AKR1C2AKR1C1ALDH1A1MAPT
SCHEMBL15630993 0.86 AKR1C2 (0.53) GCGSMN1; SMN2AKR1C2AKR1C1MAPT
SCHEMBL1468345 0.83 LMNA (0.59) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL12284352 0.83 ALDH1A1 (0.59) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL13753322 0.82 AKR1C2 (0.51) SMN1; SMN2AKR1C2AKR1C1ALDH1A1MAPT
SCHEMBL9251399 0.82 HCAR3 (0.64) SMN1; SMN2ALDH1A1MAPTNPC1RAB9A
SCHEMBL20742960 0.81 ALDH1A1 (0.49) SMN1; SMN2AKR1C2AKR1C1ALDH1A1MAPT
SCHEMBL7399156 0.80 ALDH1A1 (0.47) SMN1; SMN2AKR1C2AKR1C1ALDH1A1MAPT
SCHEMBL9248878 0.80 HCAR3 (0.59) SMN1; SMN2ALDH1A1MAPTMEN1KMT2A
SCHEMBL3991305 0.80 AKR1C2 (0.49) SMN1; SMN2AKR1C2AKR1C1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030212119-A1 Novel glucagon receptor antagonists/inverse agonists NOVO NORDISK A/S (DK) 2003-11-13 US disclosed
WO-2003053938-A1 BENZIMIDAZOLS AND INDOLS AS GLUCAGON RECEPTOR ANTAGONISTS/INVERSE AGONISTEN NOVO NORDISK A/S (DK) 2003-07-03 WO 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-20030212119-A1 Novel glucagon receptor antagonists/inverse agonists GLP1R, GCGR, GIPR GCG 7/4885SMN1; SMN2 4508/4885SIRT5 2350/4885

“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.