SCHEMBL9253207

SCHEMBL9253207

O=C1C(=CC2CCN(Cc3ccccc3)CC2)Cn2c1cc1cc(F)ccc12

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACHE P22303 12/20 0.48
BACE1 P56817 3/20 0.46
CCR3 P51677 3/20 0.44
ALDH1A1 P00352 1/20 0.44
DRD2 P14416 1/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
SIGMAR1 Q99720 1/20 0.42

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
SCHEMBL9253200 1.00 ACHE (0.48) ACHEBACE1CCR3ALDH1A1DRD2
SCHEMBL9252315 0.92 ACHE (0.48) ACHEBACE1CCR3DRD2HTR2A
SCHEMBL4508009 0.89 ACHE (0.52) ACHEBACE1ALDH1A1
SCHEMBL4508006 0.89 ACHE (0.52) ACHEBACE1ALDH1A1
SCHEMBL9260222 0.88 ACHE (0.48) ACHEBACE1
SCHEMBL9260220 0.88 ACHE (0.48) ACHEBACE1
SCHEMBL9259751 0.85 ACHE (0.63) ACHEBACE1ALDH1A1DRD2HTR2A
SCHEMBL9259753 0.85 ACHE (0.63) ACHEBACE1ALDH1A1DRD2HTR2A
SCHEMBL9844714 0.85 ACHE (0.50) ACHEBACE1
SCHEMBL9844717 0.85 ACHE (0.50) ACHEBACE1

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-0441517-A2 Tricyclic amines as novel cholinesterase inhibitors PFIZER INC. (US) 1991-08-14 EP claimed
US-5428043-A Tricyclic-cyclic amines as novel cholinesterase inhibitors PFIZER INC. (US) 1995-06-27 US disclosed
EP-0441517-A2 Tricyclic amines as novel cholinesterase inhibitors PFIZER INC. (US) 1991-08-14 EP disclosed