SCHEMBL11375575

SCHEMBL11375575

Clc1ccc(C(c2ccccc2)N2CCC(N=Cc3ccncc3)CC2)cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.45
▸ CNR2 P34972 1/20 0.45
▸ BACE1 P56817 12/20 0.41
▸ ACHE P22303 9/20 0.41
▸ BCHE P06276 5/20 0.41
▸ NPC1 O15118 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ THRB P10828 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ L3MBTL3 Q96JM7 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP3A5 P20815 1/20 0.36
▸ CHRM2 P08172 1/20 0.36
▸ HTR1A P08908 1/20 0.36
▸ ADRA2A P08913 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
SCHEMBL11375571 1.00 CNR1 (0.45) CNR1CNR2BACE1ACHEBCHE
SCHEMBL11381203 0.92 CNR1 (0.48) CNR1CNR2BACE1ACHEBCHE
SCHEMBL11381200 0.92 CNR1 (0.48) CNR1CNR2BACE1ACHEBCHE
SCHEMBL11380203 0.89 ACHE (0.47) BACE1ACHEBCHEMAPTL3MBTL3
SCHEMBL11380207 0.89 ACHE (0.47) BACE1ACHEBCHEMAPTL3MBTL3
SCHEMBL11370328 0.82 MAPT (0.59) CNR1CNR2BACE1ACHEBCHE
SCHEMBL11370326 0.82 MAPT (0.59) CNR1CNR2BACE1ACHEBCHE
SCHEMBL11373892 0.80 BACE1 (0.56) BACE1ACHEBCHEMAPTL3MBTL3
SCHEMBL11373895 0.80 BACE1 (0.56) BACE1ACHEBCHEMAPTL3MBTL3
SCHEMBL11373880 0.79 ACHE (0.62) BACE1ACHEBCHESMN1; SMN2L3MBTL3

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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