SCHEMBL24319642

SCHEMBL24319642

CCCN1CC[C@H](C)CC1CO

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 2/20 0.46
GBA2 Q9HCG7 2/20 0.37
SPHK2 Q9NRA0 2/20 0.36
SPHK1 Q9NYA1 2/20 0.36
GAA P10253 1/20 0.36
HTR1A P08908 7/20 0.35
DRD2 P14416 7/20 0.35

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
SCHEMBL24319517 1.00 GBA1 (0.46) GBA1GBA2SPHK2SPHK1GAA
SCHEMBL24319515 1.00 GBA1 (0.46) GBA1GBA2SPHK2SPHK1GAA
SCHEMBL20172082 0.83 GBA1 (0.36) GBA1HTR1ADRD2
SCHEMBL23912945 0.81 GBA1 (0.50) GBA1GBA2SPHK2SPHK1GAA
SCHEMBL20726262 0.81 GBA1 (0.50) GBA1GBA2SPHK2SPHK1GAA
SCHEMBL6628623 0.76 PHGDH (0.33) GBA1
SCHEMBL18501202 0.76 GBA1 (0.39) GBA1HTR1ADRD2
SCHEMBL7792025 0.75 SPHK2 (0.56) GBA1SPHK2SPHK1GAA
SCHEMBL11983314 0.75 SPHK2 (0.56) GBA1SPHK2SPHK1GAA
SCHEMBL12057010 0.75 SPHK2 (0.56) GBA1SPHK2SPHK1GAA

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
WO-2022047145-A1 RAPIDLY ACCELERATING FIBROSARCOMA PROTEIN DEGRADING COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2022-03-03 WO disclosed