SCHEMBL23748746

SCHEMBL23748746

O=P1(c2ccc(Br)cc2)CC=CC1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.38
CA2 P00918 3/20 0.34
CA1 P00915 2/20 0.34
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
HPGD P15428 1/20 0.31
ALDH1A1 P00352 3/20 0.31
ALOX15 P16050 2/20 0.31
MAPK1 P28482 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
SCHEMBL11548715 0.76 LMNA (0.38) CYP2A6CA2CA1CES2CES1
SCHEMBL30477561 0.67
SCHEMBL18508 0.62
SCHEMBL9635137 0.59 CYP2A6 (0.73) CYP2A6CA2CA1CES2CES1
SCHEMBL9635143 0.59 CYP2A6 (0.73) CYP2A6CA2CA1CES2CES1
SCHEMBL9496102 0.58 CYP2A6 (0.89) CYP2A6CA2CA1CES2CES1
SCHEMBL21518322 0.58
Methane SCHEMBL21489530 0.58 CYP2A6 (0.89) CYP2A6CA2CA1CES2CES1
SCHEMBL3138002 0.58
SCHEMBL330691 0.55

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230174565-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. 2023-06-08 US disclosed
US-20230174565-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. 2023-06-08 US disclosed
WO-2023016546-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. (US) 2023-02-16 WO disclosed
WO-2023016546-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. (US) 2023-02-16 WO disclosed
CN-115698003-A Heterocyclic GLP-1 agonists 加舒布鲁姆生物公司 2023-02-03 CN disclosed
EP-4097099-A1 HETEROCYCLIC GLP-1 AGONISTS Gasherbrum Bio, Inc. (US) 2022-12-07 EP disclosed
WO-2021155841-A1 HETEROCYCLIC GLP-1 AGONISTS GASHERBRUM BIO, INC. (US) 2021-08-12 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-20230174565-A1 HETEROCYCLIC GLP-1 AGONISTS GLP1R, GIPR, GCGR CYP2A6 1412/4885CA2 2913/4885CA1 3999/4885

“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.