SCHEMBL8968470

SCHEMBL8968470

N=c1c2c(Cl)cc(Cl)cc2nc2n1CCCCC2

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.64
RAB9A P51151 4/20 0.45
NPC1 O15118 3/20 0.45
LMNA P02545 2/20 0.45
POLB P06746 1/20 0.45
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HDAC6 Q9UBN7 1/20 0.42
ALDH1A1 P00352 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HSD11B1 P28845 1/20 0.38
HSD11B2 P80365 1/20 0.38
GAA P10253 1/20 0.38
HPGD P15428 1/20 0.38
HTT P42858 1/20 0.38
USP2 O75604 1/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
ALOX15 P16050 1/20 0.38
STAT1 P42224 1/20 0.38

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
SCHEMBL8969554 0.99 ACHE (0.61) ACHERAB9ANPC1LMNAPOLB
SCHEMBL8968731 0.94 ACHE (0.56) ACHERAB9ANPC1LMNAPOLB
SCHEMBL8968996 0.86 ACHE (0.61) ACHERAB9ANPC1LMNAPOLB
SCHEMBL8968447 0.83 POLB (0.58) ACHERAB9ANPC1LMNAPOLB
SCHEMBL8968425 0.83 MEN1 (0.55) ACHERAB9ANPC1LMNAPOLB
SCHEMBL8968557 0.82 POLB (0.56) ACHERAB9ANPC1LMNAPOLB
SCHEMBL8968614 0.78 ACHE (0.56) ACHERAB9ANPC1LMNAPOLB
SCHEMBL8968366 0.78 ACHE (1.00) ACHERAB9ANPC1LMNAPOLB
SCHEMBL8968656 0.78 ACHE (0.60) ACHERAB9ANPC1LMNAPOLB
SCHEMBL8969257 0.77 POLB (0.50) ACHERAB9ANPC1LMNAPOLB

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