SCHEMBL8968362

SCHEMBL8968362

COc1c(Cl)cc2c(c1OC)CN1CCCCCC1=N2

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ACHE P22303 16/20 0.55
BCHE P06276 1/20 0.37
HRH3 Q9Y5N1 1/20 0.36
ALDH1A1 P00352 3/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 1/20 0.36
CYP3A4 P08684 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
L3MBTL1 Q9Y468 1/20 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
SCHEMBL8969109 0.85 ACHE (0.50) ACHEBCHEHRH3ALDH1A1MEN1
SCHEMBL8968235 0.82 ACHE (0.50) ACHEBCHEHRH3ALDH1A1MEN1
SCHEMBL8968391 0.80 ACHE (0.59) ACHEBCHEHRH3ALDH1A1MEN1
SCHEMBL8968331 0.80 ACHE (0.47) ACHEALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL8968711 0.80 ACHE (0.47) ACHEALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL8970605 0.80 ACHE (0.55) ACHEBCHEHRH3ALDH1A1MEN1
SCHEMBL8968417 0.79 ACHE (0.48) ACHEBCHEHRH3ALDH1A1MEN1
SCHEMBL8968986 0.79 ACHE (0.58) ACHEBCHEHRH3ALDH1A1MEN1
SCHEMBL8968930 0.78 ACHE (0.47) ACHEALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL8969467 0.78 ACHE (0.47) ACHEALDH1A1MEN1KMT2ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5486512-A LEARNING ENHANCEMENT WARNER-LAMBERT COMPANY (US) 1996-01-23 US disclosed
WO-1993003034-A1 QUINAZOLINE DERIVATIVES AS ACETYLCHOLINESTERASE INHIBITORS WARNER-LAMBERT COMPANY (US) 1993-02-18 WO disclosed