SCHEMBL23748747

SCHEMBL23748747

O=P1(c2ccc(Br)cc2)CCCC1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.38
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
HPGD P15428 1/20 0.36
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
MAPK1 P28482 2/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
GSK3B P49841 2/20 0.32
OGG1 O15527 2/20 0.31
CA9 Q16790 1/20 0.31
ALOX15 P16050 2/20 0.31
ALDH1A1 P00352 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
SCHEMBL23749704 0.77 ALDH1A1 (0.42) MEN1LMNAMAPTRAB9AKMT2A
SCHEMBL23748746 0.76 CYP2A6 (0.38) CYP2A6CES2CES1HPGDCA1
SCHEMBL17447185 0.76 ACHE (0.38) CES2CES1HPGDMEN1LMNA
SCHEMBL24797720 0.70 HPGD (0.47) CES2CES1HPGDMEN1LMNA
SCHEMBL12758170 0.70 HPGD (0.47) CES2CES1HPGDMEN1LMNA
SCHEMBL13205037 0.70 HPGD (0.47) CES2CES1HPGDMEN1LMNA
SCHEMBL25431096 0.68 ALDH1A1 (0.52) HPGDMAPK1MEN1LMNAMAPT
Phosphonic Acid SCHEMBL11587480 0.67 HPGD (0.40) CES2CES1HPGDMEN1KMT2A
SCHEMBL17447179 0.64 HPGD (0.50) HPGDCA1CA2MEN1KMT2A
SCHEMBL18508 0.62

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
WO-2023146513-A1 COMPOUNDS AND METHODS OF USE THEREOF VIVACE THERAPEUTICS, INC. (US) 2023-08-03 WO disclosed
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
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 1412/4885CES2 4019/4885CES1 1144/4885

“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.