SCHEMBL30697672

SCHEMBL30697672

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

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.59
▸ TSHR P16473 1/20 0.59
▸ MAPT P10636 3/20 0.58
▸ ALDH1A1 P00352 1/20 0.54
▸ LMNA P02545 1/20 0.54
▸ GPR88 Q9GZN0 11/20 0.53
▸ RAB9A P51151 2/20 0.53
▸ CA1 P00915 1/20 0.50
▸ CA2 P00918 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ NPC1 O15118 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL12112442 0.91 TSHR (0.56) GAATSHRMAPTALDH1A1LMNA
SCHEMBL9252696 0.88 MAPT (0.62) GAATSHRMAPTALDH1A1LMNA
SCHEMBL10804894 0.87 TSHR (0.48) GAATSHRGPR88
SCHEMBL10804900 0.87 TSHR (0.48) GAATSHRGPR88
SCHEMBL8081903 0.84 MAPK1 (0.59) TSHRGPR88
SCHEMBL11349081 0.84 MAPT (0.57) GAATSHRMAPTALDH1A1LMNA
SCHEMBL20765902 0.82 MAPT (0.68) GAATSHRMAPTALDH1A1LMNA
SCHEMBL9487537 0.82 TSHR (0.50) GAATSHRMAPTGPR88KMT2A
SCHEMBL9487539 0.82 TSHR (0.50) GAATSHRMAPTGPR88KMT2A
SCHEMBL27243771 0.81 MAPT (0.66) GAATSHRMAPTALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4543857-A1 MODULATORS OF G PROTEIN-COUPLED RECEPTOR 88 ACADIA Pharmaceuticals Inc. (US) 2025-04-30 — — EP disclosed
CN-119546577-A Modulators of G protein-coupled receptor 88 阿卡蒂亚药品公司 2025-02-28 — — CN disclosed
WO-2023250060-A1 MODULATORS OF G PROTEIN-COUPLED RECEPTOR 88 ACADIA PHARMACEUTICALS INC. (US) 2023-12-28 — — WO disclosed
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