SCHEMBL8228170

SCHEMBL8228170

Cc1ccccc1C(=O)NC[C@H](N)C(N)=O

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.54
SMN1; SMN2 Q16637 4/20 0.49
MAPK1 P28482 1/20 0.49
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
P2RX7 Q99572 5/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
TP53 P04637 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
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
SCHEMBL5078458 0.88 HPGD (0.54) HPGDSMN1; SMN2MAPK1NPC1RAB9A
SCHEMBL5078462 0.88 HPGD (0.54) HPGDSMN1; SMN2MAPK1NPC1RAB9A
Carbamic Acid SCHEMBL28871458 0.81 P2RX7 (0.50) HPGDSMN1; SMN2MAPK1NPC1RAB9A
SCHEMBL3331311 0.80 HPGD (0.60) HPGDSMN1; SMN2MAPK1NPC1RAB9A
Hydrochloric Acid SCHEMBL5664014 0.80 HPGD (0.53) HPGDSMN1; SMN2MAPK1NPC1RAB9A
Hydrochloric Acid SCHEMBL5664017 0.80 HPGD (0.53) HPGDSMN1; SMN2MAPK1NPC1RAB9A
Hydrochloric Acid SCHEMBL5664023 0.80 HPGD (0.53) HPGDSMN1; SMN2MAPK1NPC1RAB9A
SCHEMBL13162706 0.79 HPGD (0.58) HPGDSMN1; SMN2MAPK1NPC1RAB9A
SCHEMBL5856133 0.79 HPGD (0.58) HPGDSMN1; SMN2MAPK1NPC1RAB9A
SCHEMBL14607897 0.78 HPGD (0.57) HPGDSMN1; SMN2MAPK1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101400699-A Human glucagon-like-peptide-1 modulators and their use in the treatment of diabetes and related conditions BRISTOL MYERS SQUIBB CO (US) 2009-04-01 CN claimed
CN-101400699-A Human glucagon-like-peptide-1 modulators and their use in the treatment of diabetes and related conditions BRISTOL MYERS SQUIBB CO (US) 2009-04-01 CN disclosed
US-20070238669-A1 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MODULATORS AND THEIR USE IN THE TREATMENT OF DIABETES RELATED CONDITIONS BRISTOL-MYERS SQUIBB COMPANY 2007-10-11 US disclosed
US-20070238669-A1 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MODULATORS AND THEIR USE IN THE TREATMENT OF DIABETES RELATED CONDITIONS BRISTOL-MYERS SQUIBB COMPANY 2007-10-11 US disclosed
WO-2007082264-A2 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MODULATORS AND THEIR USE IN THE TREATMENT OF DIABETES AND RELATED CONDITIONS BRISTOL-MYERS SQUIBB COMPANY (US) 2007-07-19 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-20070238669-A1 HUMAN GLUCAGON-LIKE-PEPTIDE-1 MODULATORS AND THEIR USE IN THE TREATMENT OF DIABETES RELATED CONDITIONS GLP1R, GIPR, IAPP HPGD 2659/4885SMN1; SMN2 1582/4885MAPK1 2059/4885

“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.