SCHEMBL14615359

SCHEMBL14615359

CCCc1ccc(CN2CCOCC2)cc1CC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 3/20 0.50
▸ KDM4E B2RXH2 2/20 0.50
▸ MAPT P10636 2/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.48
▸ HPGD P15428 2/20 0.48
▸ HSD17B10 Q99714 2/20 0.48
▸ NPC1 O15118 2/20 0.48
▸ TP53 P04637 2/20 0.48
▸ TSHR P16473 2/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ NCF1 P14598 1/20 0.47
▸ ALDH1A1 P00352 2/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ GLA P06280 1/20 0.46
▸ GAA P10253 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46

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
SCHEMBL14035869 0.82 HRH3 (0.53) HRH3MAPTSMN1; SMN2HPGDHSD17B10
SCHEMBL13061370 0.79 HRH3 (0.67) HRH3KDM4EMAPTSMN1; SMN2HPGD
SCHEMBL20195827 0.78 LMNA (0.49) KDM4EHPGDNPC1TP53RAB9A
SCHEMBL10397056 0.77 HTT (0.52) HRH3KDM4EMAPTSMN1; SMN2HPGD
SCHEMBL10244180 0.77 NCF1 (0.67) HRH3KDM4EMAPTSMN1; SMN2HPGD
SCHEMBL4106074 0.76 CYP2A13 (0.65) KDM4EMAPTHPGDHSD17B10MEN1
SCHEMBL27594166 0.76 HPGD (0.51) HRH3KDM4EMAPTSMN1; SMN2HPGD
SCHEMBL27705945 0.76 SMN1; SMN2 (0.51) HRH3KDM4EMAPTSMN1; SMN2HPGD
SCHEMBL301839 0.76 HRH3 (0.71) HRH3MAPTSMN1; SMN2HPGDHSD17B10
SCHEMBL25629312 0.74 ALDH1A1 (0.39) HRH3KDM4ESMN1; SMN2MEN1KMT2A

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
EP-1757584-A1 Heterocyclic substituted amides, their production and their use Abbott GmbH & Co. KG (DE) 2007-02-28 — — EP disclosed
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