SCHEMBL30103447

SCHEMBL30103447

NCC1CCC(COCc2ccccc2)OC1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.45
LMNA P02545 1/20 0.45
DRD1 P21728 1/20 0.44
HRH4 Q9H3N8 4/20 0.43
HRH3 Q9Y5N1 4/20 0.43
SLC6A2 P23975 3/20 0.40
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 2/20 0.40
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40
CTSK P43235 1/20 0.40
TSHR P16473 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
BACE1 P56817 1/20 0.37

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
SCHEMBL5513936 0.89 TAAR1 (0.45) TAAR1LMNADRD1HRH4HRH3
SCHEMBL5518091 0.89 TAAR1 (0.45) TAAR1LMNADRD1HRH4HRH3
SCHEMBL5513930 0.89 TAAR1 (0.45) TAAR1LMNADRD1HRH4HRH3
SCHEMBL30063100 0.82 TAAR1 (0.47) TAAR1LMNADRD1HRH4HRH3
SCHEMBL25308726 0.81 LMNA (0.48) TAAR1LMNADRD1HRH4HRH3
SCHEMBL1566074 0.81 LMNA (0.48) TAAR1LMNADRD1HRH4HRH3
SCHEMBL25309758 0.81 LMNA (0.48) TAAR1LMNADRD1HRH4HRH3
SCHEMBL417603 0.81 LMNA (0.48) TAAR1LMNADRD1HRH4HRH3
SCHEMBL5519586 0.81 TDP1 (0.54) TAAR1LMNAHRH4HRH3CTSL
SCHEMBL5527189 0.80 HRH4 (0.43) TAAR1LMNAHRH4HRH3SLC6A2

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-4097138-A1 ASGPR-BINDING COMPOUNDS FOR THE DEGRADATION OF EXTRACELLULAR PROTEINS Avila Therapeutics, Inc. (US) 2022-12-07 EP disclosed