SCHEMBL8437407

SCHEMBL8437407

COc1ccc2c(C(N)CN)ccc(N=Nc3ccccc3)c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 10/20 0.39
▸ KMT2A Q03164 10/20 0.39
▸ RAB9A P51151 4/20 0.39
▸ NPC1 O15118 4/20 0.39
▸ HSP90AA1 P07900 2/20 0.38
▸ KCNH2 Q12809 1/20 0.38
▸ L3MBTL1 Q9Y468 4/20 0.38
▸ MYC P01106 1/20 0.38
▸ MAPT P10636 6/20 0.38
▸ TDP1 Q9NUW8 5/20 0.38
▸ MAPK1 P28482 4/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ OPRK1 P41145 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ LMNA P02545 3/20 0.38
▸ POLB P06746 1/20 0.38
▸ CYP19A1 P11511 1/20 0.37
▸ HTR2A P28223 1/20 0.36

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
SCHEMBL8441865 0.95 MEN1 (0.40) MEN1KMT2ARAB9ANPC1HSP90AA1
Diethylamine SCHEMBL8437515 0.85 MEN1 (0.40) MEN1KMT2ARAB9ANPC1L3MBTL1
SCHEMBL8437514 0.83 HTT (0.40) MEN1KMT2AKCNH2MAPTSMN1; SMN2
SCHEMBL8441206 0.82 MEN1 (0.54) MEN1KMT2ARAB9ANPC1KCNH2
SCHEMBL8441513 0.76 MAOB (0.43) MEN1KMT2ARAB9ANPC1L3MBTL1
SCHEMBL8437411 0.75 FERMT2 (0.49) MEN1KMT2ARAB9ANPC1HSP90AA1
SCHEMBL8441127 0.74 MEN1 (0.41) MEN1KMT2ARAB9ANPC1HSP90AA1
SCHEMBL8441871 0.73 FERMT2 (0.49) MEN1KMT2ARAB9ANPC1HSP90AA1
SCHEMBL8441592 0.73 SENP3 (0.41) MEN1KMT2ARAB9ANPC1L3MBTL1
SCHEMBL8440239 0.72 CYP2D6 (0.43) MEN1KMT2AKCNH2MAPTTDP1

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
US-5955472-A INHIBITION OF AMYLOID AGGREGATION IN ANIMALS AND PREVENTION OF ALZHEIMER'S DISEASE WARNER-LAMBERT COMPANY (US) 1999-09-21 — — US claimed
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