SCHEMBL31536639

SCHEMBL31536639

CC(C)(C)OC(=O)N1[C@@H](C(O)c2ncco2)COC1(C)C

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 1/20 0.40
FAAH O00519 1/20 0.37
BRD4 O60885 1/20 0.35
GPR119 Q8TDV5 1/20 0.32
NR1H2 P55055 1/20 0.31
HSD11B2 P80365 1/20 0.30

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
SCHEMBL31536674 0.85 SPHK1 (0.41) SPHK1FAAHBRD4
SCHEMBL6736498 0.80 SPHK1 (0.38) SPHK1BRD4GPR119NR1H2
SCHEMBL6741524 0.80 SPHK1 (0.38) SPHK1BRD4GPR119NR1H2
SCHEMBL20263037 0.80 GPR119 (0.40) SPHK1BRD4GPR119
SCHEMBL20263034 0.80 GPR119 (0.40) SPHK1BRD4GPR119
SCHEMBL16553345 0.76 SPHK1 (0.46) SPHK1BRD4GPR119NR1H2HSD11B2
SCHEMBL16553346 0.76 SPHK1 (0.46) SPHK1BRD4GPR119NR1H2HSD11B2
SCHEMBL15336587 0.76 SPHK1 (0.46) SPHK1BRD4GPR119NR1H2HSD11B2
SCHEMBL30669036 0.76 SPHK1 (0.46) SPHK1BRD4GPR119NR1H2HSD11B2
SCHEMBL6208986 0.75 SPHK1 (0.39) SPHK1BRD4HSD11B2

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-2025080946-A2 RAS INHIBITORS Revolution Medicines, Inc. (US) 2025-04-17 WO disclosed