SCHEMBL30320119

SCHEMBL30320119

N[C@H]1N=C(C2CCCCC2)c2ccccc2N(CC(=O)O)C1=O

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 14/20 0.47
CCKAR P32238 5/20 0.47
TRPA1 O75762 1/20 0.42
OXTR P30559 1/20 0.42
BDKRB1 P46663 1/20 0.42
MME P08473 1/20 0.41
ACE P12821 1/20 0.41

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
SCHEMBL2687501 1.00 CCKBR (0.47) CCKBRCCKARTRPA1OXTRBDKRB1
SCHEMBL30467339 0.91 CCKBR (0.41) CCKBRCCKAROXTRBDKRB1MME
SCHEMBL12893383 0.86 CCKBR (0.49) CCKBRCCKARTRPA1BDKRB1
SCHEMBL8774054 0.85 CCKBR (0.44) CCKBRCCKAROXTRBDKRB1
SCHEMBL8774043 0.85 CCKBR (0.44) CCKBRCCKAROXTRBDKRB1
SCHEMBL9058638 0.84 CCKBR (0.44) CCKBRCCKAROXTRBDKRB1
SCHEMBL9058636 0.84 CCKBR (0.44) CCKBRCCKAROXTRBDKRB1
SCHEMBL8773971 0.84 CCKBR (0.45) CCKBRCCKARTRPA1BDKRB1
SCHEMBL8773965 0.84 CCKBR (0.45) CCKBRCCKARTRPA1BDKRB1
SCHEMBL9302353 0.83 BDKRB1 (0.42) CCKBRCCKARTRPA1BDKRB1

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
EP-4153310-B1 BBETA-15-42 FOR THE TREATMENT OF VIRAL ENDOTHELITIS F4 PHARMA GMBH (AT) 2026-02-18 EP disclosed
CN-116348128-A Bβ15-42 for treating viral endopdermatitis F4医药有限责任公司 2023-06-27 CN disclosed
EP-4153310-A1 BBETA-15-42 FOR THE TREATMENT OF VIRAL ENDOTHELITIS F4 Pharma GmbH (AT) 2023-03-29 EP disclosed