SCHEMBL9380245

SCHEMBL9380245

FC(F)(F)OC1c2ccc(Br)cc2N=C2CCCCCN21

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACHE P22303 9/20 0.33
HPGD P15428 2/20 0.33
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL9385658 0.84 ACHE (0.42) ACHELMNA
SCHEMBL9380948 0.78 ACHE (0.39) ACHEHPGDLMNAHTTSMN1; SMN2
SCHEMBL9381879 0.72 GALR2 (0.34) ACHE
SCHEMBL9381904 0.65 ACHE (0.51) ACHEHPGDHTTSMN1; SMN2
SCHEMBL9382126 0.65 ACHE (0.34) ACHE
SCHEMBL8970334 0.65 NOS3 (0.42) ACHEHPGDHTT
SCHEMBL9379110 0.65 ACHE (0.39) ACHEHPGDSMN1; SMN2
SCHEMBL9381689 0.65 ACHE (0.48) ACHELMNA
SCHEMBL25835641 0.64 KLK7 (0.49) ACHELMNA
SCHEMBL6921297 0.63 ACHE (0.70) ACHELMNAHTT

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-0597956-A1 QUINAZOLINE DERIVATIVES AS ACETYLCHOLINESTERASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1994-05-25 EP disclosed