SCHEMBL26694792

SCHEMBL26694792

COc1ccc(CO[C@@H]2C[C@@H](C(=O)O)N(C(=O)O)C2)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.46
AGTR2 P50052 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.44
POLB P06746 1/20 0.44
RAB9A P51151 1/20 0.44
FFAR2 O15552 1/20 0.43
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
FFAR1 O14842 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
BDKRB2 P30411 1/20 0.40
PLA2G4B P0C869 1/20 0.40
FABP7 O15540 1/20 0.39
FABP5 Q01469 1/20 0.39

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
SCHEMBL116041 0.86 AGTR2 (0.48) AGTR2POLBALDH1A1BDKRB2FABP7
SCHEMBL9603360 0.85 AGTR2 (0.59) AGTR2BDKRB2
SCHEMBL27224005 0.85 AGTR2 (0.59) AGTR2BDKRB2
SCHEMBL9033440 0.85 AGTR2 (0.59) AGTR2BDKRB2
SCHEMBL9033443 0.85 AGTR2 (0.59) AGTR2BDKRB2
SCHEMBL3784713 0.85 AGTR2 (0.59) AGTR2BDKRB2
SCHEMBL26695058 0.84 TP53 (0.40) NAAASMN1; SMN2NPC1POLBRAB9A
SCHEMBL29385791 0.79 AGTR2 (0.46) AGTR2POLBALDH1A1BDKRB2
SCHEMBL13729227 0.79 AGTR2 (0.46) AGTR2POLBALDH1A1BDKRB2
SCHEMBL5635251 0.78 AGTR2 (0.57) AGTR2BDKRB2

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-20240025919-A1 AZA-TETRACYCLIC OXAZEPINE COMPOUNDS AND USES THEREOF GENENTECH, INC. 2024-01-25 US disclosed
WO-2023225302-A1 AZA-TETRACYCLIC OXAZEPINE COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2023-11-23 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-20240025919-A1 AZA-TETRACYCLIC OXAZEPINE COMPOUNDS AND USES THEREOF AZI2, TET3, OXA1L NAAA 1495/4885AGTR2 3720/4885SMN1; SMN2 2361/4885

“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.