SCHEMBL25367385

SCHEMBL25367385

O=C(O)Nc1ccc(NC[C@@H]2CCO2)c([N+](=O)[O-])c1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 1/20 0.64
ALDH1A1 P00352 6/20 0.62
NPC1 O15118 4/20 0.62
RAB9A P51151 4/20 0.62
SMN1; SMN2 Q16637 4/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
MAPT P10636 10/20 0.61
KMT2A Q03164 7/20 0.61
MEN1 O00255 5/20 0.61
MAPK1 P28482 3/20 0.61
KDM4E B2RXH2 1/20 0.61
CYP1A2 P05177 1/20 0.61
CYP2C9 P11712 1/20 0.61
HPGD P15428 1/20 0.61
CYP2C19 P33261 1/20 0.61
TP53 P04637 1/20 0.49
POLB P06746 1/20 0.49
LMNA P02545 1/20 0.45

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
SCHEMBL25367390 1.00 HCAR3 (0.64) HCAR3ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL26914018 0.90 MAPT (0.60) HCAR3ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL26914012 0.90 MAPT (0.60) HCAR3ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL4966338 0.89 HCAR3 (0.54) HCAR3ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL4966333 0.89 HCAR3 (0.54) HCAR3ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL3922767 0.86 HCAR3 (0.50) HCAR3ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL3922764 0.86 HCAR3 (0.50) HCAR3ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL30537061 0.84 MAPT (0.56) HCAR3ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL29052937 0.84 MAPT (0.56) HCAR3ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL29052936 0.84 MAPT (0.56) HCAR3ALDH1A1NPC1RAB9ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240083886-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. 2024-03-14 US disclosed
WO-2023164358-A1 GLP-1R MODULATING COMPOUNDS ASCLETIS BIOSCIENCE CO., LTD. (CN) 2023-08-31 WO disclosed
US-20230271949-A1 GLP-1R MODULATING COMPOUNDS ASCLETIS BIOSCIENCE CO., LTD. (CN) 2023-08-31 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-20230271949-A1 GLP-1R MODULATING COMPOUNDS GLP1R, GIPR, GPR119 HCAR3 230/4885ALDH1A1 3386/4885NPC1 1714/4885
US-20240083886-A1 HETEROCYCLIC GLP-1 AGONISTS GLP1R, GIPR, GCGR HCAR3 310/4885ALDH1A1 1011/4885NPC1 1291/4885

“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.