SCHEMBL11384082

SCHEMBL11384082

COc1cccc(-c2ccccc2CN2CCC(NCc3ccccc3)CC2)c1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.62
▸ KMT2A Q03164 3/20 0.62
▸ HTR7 P34969 1/20 0.56
▸ POLB P06746 1/20 0.55
▸ ACHE P22303 9/20 0.54
▸ BACE1 P56817 9/20 0.54
▸ BCHE P06276 6/20 0.54
▸ ALDH1A1 P00352 1/20 0.51
▸ SIGMAR1 Q99720 1/20 0.51
▸ MLNR O43193 1/20 0.48
▸ HTR5A P47898 1/20 0.48
▸ CCR3 P51677 2/20 0.48
▸ CARM1 Q86X55 1/20 0.48
▸ PRMT6 Q96LA8 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
SCHEMBL11374561 0.86 ACHE (0.67) MEN1KMT2AHTR7POLBACHE
SCHEMBL11371332 0.84 HTR7 (0.51) MEN1KMT2AHTR7POLBACHE
SCHEMBL11368370 0.81 HTR7 (0.64) MEN1KMT2AHTR7BACE1SIGMAR1
SCHEMBL11370258 0.80 ACHE (0.61) MEN1KMT2APOLBACHEBACE1
SCHEMBL11375011 0.76 HTR7 (0.55) HTR7ACHEBACE1BCHE
SCHEMBL1111716 0.76 HTR7 (0.66) MEN1KMT2AHTR7BACE1SIGMAR1
SCHEMBL9325044 0.76 TACR1 (0.58) HTR7
SCHEMBL11371638 0.75 ACHE (0.68) MEN1KMT2APOLBACHEBACE1
SCHEMBL5093015 0.73 KMT2A (0.69) MEN1KMT2APOLBACHEBACE1
SCHEMBL29764262 0.73 HTR7 (0.73) HTR7ALDH1A1

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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