SCHEMBL31052238

SCHEMBL31052238

Oc1ccc(N2CCNCC2)c2c1OCCO2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 1.00
DRD3 P35462 9/20 1.00
DRD1 P21728 4/20 1.00
HTR2A P28223 4/20 1.00
SIGMAR1 Q99720 1/20 1.00
DRD4 P21917 6/20 0.67
ADRB1 P08588 2/20 0.58
HTR6 P50406 5/20 0.43
DRD5 P21918 2/20 0.40

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
SCHEMBL31052127 0.81 DRD2 (0.73) DRD2DRD3DRD1HTR2ASIGMAR1
SCHEMBL31051863 0.80 DRD2 (0.67) DRD2DRD3DRD1HTR2ASIGMAR1
SCHEMBL31051854 0.80 DRD2 (0.67) DRD2DRD3DRD1HTR2ASIGMAR1
SCHEMBL31051932 0.80 DRD2 (1.00) DRD2DRD3DRD1HTR2ASIGMAR1
SCHEMBL31051808 0.80 DRD2 (0.71) DRD2DRD3DRD1HTR2ASIGMAR1
SCHEMBL31051724 0.80 DRD2 (0.67) DRD2DRD3DRD1HTR2ASIGMAR1
SCHEMBL31051828 0.80 DRD2 (0.71) DRD2DRD3DRD1HTR2ASIGMAR1
SCHEMBL7814738 0.80 DRD2 (0.67) DRD2DRD3DRD1HTR2ASIGMAR1
SCHEMBL31051887 0.80 DRD2 (0.66) DRD2DRD3DRD1HTR2ASIGMAR1
SCHEMBL31051880 0.79 DRD2 (0.65) DRD2DRD3DRD1HTR2ASIGMAR1

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-4678188-A1 PHARMACEUTICAL COMPOSITION FOR TREATING, PREVENTING, OR MANAGING BILIRUBIN-INDUCED NEUROLOGICAL DYSFUNCTION, PSYCHIATRIC DISORDERS ASSOCIATED WITH JAUNDICE, OR PSYCHIATRIC DISORDERS CAUSED BY BILIRUBIN UDP-GLUCURONOSYLTRANSFERASE GENE MUTATIONS Ohnishi, Arata (JP) 2026-01-14 EP disclosed
WO-2024185842-A1 PHARMACEUTICAL COMPOSITION FOR TREATING, PREVENTING, OR MANAGING BILIRUBIN-INDUCED NEUROLOGICAL DYSFUNCTION, PSYCHIATRIC DISORDERS ASSOCIATED WITH JAUNDICE, OR PSYCHIATRIC DISORDERS CAUSED BY BILIRUBIN UDP-GLUCURONOSYLTRANSFERASE GENE MUTATIONS 国立大学法人島根大学 2024-09-12 WO disclosed