SCHEMBL31071012

SCHEMBL31071012

NCC1OCCc2ccc3c(c21)OCCO3

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.44
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
KEAP1 Q14145 1/20 0.39
DRD1 P21728 3/20 0.37
LARS1 Q9P2J5 4/20 0.36

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
SCHEMBL19813055 0.90 TAAR1 (0.43) TAAR1MTNR1AMTNR1BKEAP1DRD1
SCHEMBL30360711 0.90 TAAR1 (0.43) TAAR1MTNR1AMTNR1BKEAP1DRD1
SCHEMBL32670720 0.90 TAAR1 (0.43) TAAR1MTNR1AMTNR1BKEAP1DRD1
SCHEMBL19813056 0.90 TAAR1 (0.43) TAAR1MTNR1AMTNR1BKEAP1DRD1
SCHEMBL19813086 0.90 TAAR1 (0.43) TAAR1MTNR1AMTNR1BKEAP1DRD1
SCHEMBL30360682 0.90 TAAR1 (0.43) TAAR1MTNR1AMTNR1BKEAP1DRD1
SCHEMBL19821154 0.86 TAAR1 (0.47) TAAR1KEAP1DRD1LARS1
SCHEMBL19821152 0.86 TAAR1 (0.47) TAAR1KEAP1DRD1LARS1
SCHEMBL32670732 0.81 TAAR1 (0.48) TAAR1MTNR1AMTNR1B
SCHEMBL30360763 0.81 TAAR1 (0.48) TAAR1MTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3494119-B1 COMPOUNDS AND COMPOSITIONS AND USES THEREOF SUMITOMO PHARMA AMERICA INC (US) 2024-09-04 EP disclosed