SCHEMBL11371346

SCHEMBL11371346

Cc1ccccc1-c1ccccc1CN1CCC(N=Cc2ccncc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 14/20 0.52
▸ ACHE P22303 13/20 0.52
▸ BCHE P06276 11/20 0.47
▸ MEN1 O00255 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ HTR7 P34969 1/20 0.42
▸ CYP3A4 P08684 1/20 0.40

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
SCHEMBL11375582 0.80 BACE1 (0.49) BACE1ACHEBCHEMEN1ALDH1A1
SCHEMBL5850067 0.78 BACE1 (0.82) BACE1ACHEBCHE
SCHEMBL5850070 0.78 BACE1 (0.82) BACE1ACHEBCHE
SCHEMBL11376120 0.77 BACE1 (0.66) BACE1ACHEBCHE
SCHEMBL11372233 0.75 BACE1 (0.65) BACE1ACHEBCHEHTR7
SCHEMBL11378628 0.74 ACHE (0.52) BACE1ACHEBCHEMEN1KMT2A
SCHEMBL11371772 0.73 ACHE (0.56) ACHEALDH1A1KMT2AHTR7
SCHEMBL6791318 0.70 HTR7 (0.59) ACHEMEN1ALDH1A1KMT2AHTR7
SCHEMBL11381210 0.70 BACE1 (0.59) BACE1ACHEBCHE
SCHEMBL11381943 0.70 KMT2A (0.49) BACE1ACHEBCHEMEN1ALDH1A1

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-4267318-A 1-(Diarylmethyl)-4-piperidinamine and derivatives thereof G. D. SEARLE & CO. (US) 1981-05-12 — — US disclosed
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