SCHEMBL9583223

SCHEMBL9583223

Fc1cccc2nc3c(c(NCCC(c4ccccc4)c4ccccc4)c12)CCCO3

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 9/20 0.55
▸ ALDH1A1 P00352 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ BCHE P06276 2/20 0.33

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
SCHEMBL9583434 0.84 ACHE (0.55) ACHEBCHE
SCHEMBL9583346 0.79 ACHE (0.57) ACHE
SCHEMBL9583926 0.78 ACHE (0.67) ACHEALDH1A1CYP1A2
SCHEMBL9211409 0.71 ACHE (1.00) ACHEBCHE
SCHEMBL9215322 0.61 ACHE (1.00) ACHEALDH1A1CYP1A2BCHE
SCHEMBL9583737 0.60 ACHE (1.00) ACHEALDH1A1CYP1A2BCHE
SCHEMBL9583526 0.57 ACHE (1.00) ACHEALDH1A1CYP1A2BCHE
SCHEMBL22930961 0.57 BCHE (0.72) ACHEBCHE
Milverine SCHEMBL2110179 0.55 EPHX2 (0.55) ALDH1A1CYP1A2
SCHEMBL16915698 0.55 PDE5A (0.50) ACHEALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5202440-A Certain 9-amino-2-(or 4)-oxa 1,2,3,4-tetrahydro- or 1,2,3,4,5,6,7,8-octahydro-acridines PFIZER INC. (US) 1993-04-13 — — US disclosed
EP-0311303-A2 4-aminopyridine derivatives PFIZER INC. (US) 1989-04-12 — — EP disclosed
WO-1989002739-A1 4-AMINOPYRIDINE DERIVATIVES PFIZER INC. (US) 1989-04-06 — — WO disclosed
WO-1989002740-A1 4-AMINOPYRIDINE DERIVATIVES PFIZER INC. (US) 1989-04-06 — — WO disclosed
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