SCHEMBL10696583

SCHEMBL10696583

O=[C]CCCN1CCC(NCc2ccccc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CARM1 Q86X55 2/20 0.61
▸ PRMT6 Q96LA8 2/20 0.61
▸ ACHE P22303 13/20 0.61
▸ BACE1 P56817 13/20 0.61
▸ BCHE P06276 10/20 0.61
▸ MEN1 O00255 2/20 0.54
▸ KMT2A Q03164 2/20 0.54
▸ CYP2C9 P11712 1/20 0.48
▸ HRH3 Q9Y5N1 1/20 0.48
▸ FABP6 P51161 1/20 0.48

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
SCHEMBL10770315 0.96 CARM1 (0.60) CARM1PRMT6ACHEBACE1BCHE
SCHEMBL18658247 0.82 CARM1 (0.70) CARM1PRMT6ACHEBACE1BCHE
SCHEMBL20492896 0.81 CARM1 (0.68) CARM1PRMT6ACHEBACE1BCHE
SCHEMBL5272937 0.80 ACHE (0.71) CARM1PRMT6ACHEBACE1BCHE
SCHEMBL20492895 0.80 CARM1 (0.67) CARM1PRMT6ACHEBACE1BCHE
SCHEMBL4499743 0.79 CARM1 (0.74) CARM1PRMT6ACHEBACE1BCHE
SCHEMBL17102128 0.78 CARM1 (0.65) CARM1PRMT6ACHEBACE1BCHE
SCHEMBL14367985 0.76 ACHE (1.00) ACHEBACE1BCHEMEN1KMT2A
SCHEMBL5544531 0.75 SIGMAR1 (0.73) —
SCHEMBL20492650 0.75 CARM1 (0.64) CARM1PRMT6ACHEBACE1BCHE

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
EP-0252482-A2 7-Acyloxy-6-aminoacyloxypolyoxylabdanes, process for their preparation and their use as medicine HOECHST AKTIENGESELLSCHAFT (DE) 1988-01-13 — — EP disclosed
EP-0217372-A2 Polyoxygenated labdane derivatives, process for their preparation and their use as medicaments HOECHST AKTIENGESELLSCHAFT (DE) 1987-04-08 — — EP disclosed
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