SCHEMBL31395231

SCHEMBL31395231

CCCC(C)COc1ccc(C(=O)N(C)OC)cc1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GPR88 Q9GZN0 18/20 0.47
▸ ABCB1 P08183 1/20 0.43

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
SCHEMBL30697569 0.82 GPR88 (0.43) GPR88
SCHEMBL30697672 0.80 GAA (0.59) GPR88
SCHEMBL8081903 0.80 MAPK1 (0.59) GPR88
SCHEMBL13221522 0.80 TSHR (0.55) —
SCHEMBL6539277 0.77 TP53 (0.60) —
SCHEMBL10804900 0.76 TSHR (0.48) GPR88ABCB1
SCHEMBL8084860 0.76 RARB (0.59) GPR88
SCHEMBL10804894 0.76 TSHR (0.48) GPR88ABCB1
SCHEMBL30697579 0.76 GPR88 (0.50) GPR88
SCHEMBL6935832 0.74 CYP2C9 (0.49) GPR88

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
CN-119546577-A Modulators of G protein-coupled receptor 88 阿卡蒂亚药品公司 2025-02-28 — — CN disclosed
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