SCHEMBL30130482

SCHEMBL30130482

CN(CCCC1(c2ccc(Cl)cc2)OCc2cc(-c3cccc(C(F)(F)F)c3)ccc21)CC(=O)O

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 3/20 0.52
ACHE P22303 1/20 0.48
BCHE P06276 1/20 0.48
LMNA P02545 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL3406535 1.00 SLC6A4 (0.52) SLC6A4ACHEBCHELMNAMAPK1
SCHEMBL468409 0.92 SLC6A4 (0.52) SLC6A4ACHELMNAMAPK1
SCHEMBL30130512 0.92 SLC6A4 (0.52) SLC6A4ACHELMNAMAPK1
SCHEMBL3408176 0.90 SLC6A4 (0.56) SLC6A4ACHELMNAMAPK1
SCHEMBL30130509 0.90 SLC6A4 (0.56) SLC6A4ACHELMNAMAPK1
SCHEMBL30130500 0.89 SLC6A4 (0.52) SLC6A4ACHEBCHE
SCHEMBL3405322 0.89 SLC6A4 (0.52) SLC6A4ACHEBCHE
SCHEMBL21065413 0.87 SLC6A4 (0.47) SLC6A4ACHELMNAMAPK1
SCHEMBL3404814 0.86 SLC6A4 (0.52) SLC6A4ACHELMNAMAPK1
SCHEMBL30130448 0.86 SLC6A4 (0.52) SLC6A4ACHELMNAMAPK1

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
US-11529342-B2 Sorbic and benzoic acid and derivatives thereof enhance the activity of a neuropharmaceutical LOS ANGELES BIOMEDICAL RESEARCH INSTITUTE AT HARBOR-UCLA MEDICAL CENTER (US) 2022-12-20 US disclosed