SCHEMBL22265151

SCHEMBL22265151

CC(=O)O[C@@H](CCN1CCC(C(=O)O)(c2ccccc2)CC1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.58
OPRL1 P41146 1/20 0.48
OPRM1 P35372 3/20 0.46
OPRD1 P41143 3/20 0.46
OPRK1 P41145 3/20 0.46

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
SCHEMBL8187804 1.00 KCNA3 (0.58) KCNA3OPRL1OPRM1OPRD1OPRK1
SCHEMBL8220314 0.91 KCNA3 (0.56) KCNA3
SCHEMBL8188731 0.81 KCNA3 (0.58) KCNA3OPRL1
SCHEMBL14305103 0.79 MEN1 (0.59)
SCHEMBL8387371 0.75 OPRM1 (0.47) KCNA3OPRM1OPRD1OPRK1
SCHEMBL9065208 0.74 OPRM1 (0.65) KCNA3OPRM1OPRD1OPRK1
SCHEMBL3561518 0.74 AKR1C1 (0.54) KCNA3OPRM1OPRD1OPRK1
SCHEMBL9396812 0.74 KMT2A (0.56) KCNA3OPRM1OPRD1OPRK1
SCHEMBL11721858 0.74 AKR1C1 (0.54) KCNA3OPRM1OPRD1OPRK1
SCHEMBL503892 0.73 OPRM1 (0.73) KCNA3OPRM1OPRD1OPRK1

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
EP-3914246-A1 LOCAL ANESTHETIC FOR THE TREATMENT OF NEUROLOGICAL SYMPTOMS RESULTING FROM BRAIN DYSFUNCTIONS ICM (Institut du Cerveau et de la Moelle Épinière) (FR) 2021-12-01 EP disclosed
WO-2020152212-A1 LOCAL ANESTHETIC FOR THE TREATMENT OF NEUROLOGICAL SYMPTOMS RESULTING FROM BRAIN DYSFUNCTIONS ICM (INSTITUT DU CERVEAU ET DE LA MOELLE ÉPINIÈRE) (FR) 2020-07-30 WO disclosed