SCHEMBL29422947

SCHEMBL29422947

CN1CCC2CCc3ccncc3C21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.43
CHRNB2 P17787 2/20 0.43
CHRNA4 P43681 2/20 0.43
CHRNA7 P36544 1/20 0.43
FDPS P14324 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
SCHEMBL7246721 1.00 ACHE (0.43) ACHECHRNB2CHRNA4CHRNA7FDPS
SCHEMBL7246724 1.00 ACHE (0.43) ACHECHRNB2CHRNA4CHRNA7FDPS
SCHEMBL7246720 1.00 ACHE (0.43) ACHECHRNB2CHRNA4CHRNA7FDPS
SCHEMBL7240759 0.88 ACHE (0.46) ACHE
SCHEMBL7240762 0.88 ACHE (0.46) ACHE
SCHEMBL7240765 0.88 ACHE (0.46) ACHE
SCHEMBL3819190 0.86 CHRNB2 (0.38) ACHECHRNB2CHRNA4CHRNA7
Hydrochloric Acid SCHEMBL52345 0.85 CHRNB2 (0.37) ACHECHRNB2CHRNA4CHRNA7
Hydrochloric Acid SCHEMBL3134497 0.85 CHRNB2 (0.37) ACHECHRNB2CHRNA4CHRNA7
SCHEMBL4541235 0.75 ACHE (0.39) ACHECHRNB2CHRNA4CHRNA7

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
EP-3972582-A1 COMPOSITIONS COMPRISING BIOLOGICALLY ACTIVE AGENTS AND BILE SALTS Poviva Corp. (US) 2022-03-30 EP disclosed