SCHEMBL31395407

SCHEMBL31395407

[2H]C([2H])([2H])[C@@H](CCC)COc1ccc([C@@H](N)C(C)(C)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GPR88 Q9GZN0 19/20 0.47
▸ FFAR1 O14842 1/20 0.40

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
SCHEMBL31395423 1.00 GPR88 (0.47) GPR88FFAR1
SCHEMBL30697600 0.94 GPR88 (0.46) GPR88FFAR1
SCHEMBL30697617 0.94 GPR88 (0.46) GPR88FFAR1
SCHEMBL31395387 0.91 GPR88 (0.55) GPR88
SCHEMBL2525269 0.91 GPR88 (0.55) GPR88
SCHEMBL1585022 0.91 GPR88 (0.55) GPR88
SCHEMBL31395382 0.91 GPR88 (0.55) GPR88
SCHEMBL30697602 0.88 GPR88 (0.39) GPR88FFAR1
SCHEMBL31395302 0.88 GPR88 (0.39) GPR88FFAR1
SCHEMBL30697658 0.87 GPR88 (0.47) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250367158-A1 MODULATORS OF G PROTEIN-COUPLED RECEPTOR 88 ACADIA PHARM INC (US) 2025-12-04 — — US disclosed
CN-119546577-A Modulators of G protein-coupled receptor 88 阿卡蒂亚药品公司 2025-02-28 — — CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20250367158-A1 MODULATORS OF G PROTEIN-COUPLED RECEPTOR 88 GPR88, GPR68, HTR2A GPR88 1/4885FFAR1 227/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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