SCHEMBL10519952

SCHEMBL10519952

OC(CC1CCN(Cc2ccccc2)CC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 1/20 0.59
CHRM3 P20309 2/20 0.59
CXCR4 P61073 1/20 0.56
ACHE P22303 5/20 0.55
BCHE P06276 2/20 0.55
KCNH2 Q12809 1/20 0.55
HRH1 P35367 1/20 0.53
ALDH1A1 P00352 1/20 0.52
CHRM2 P08172 1/20 0.51
CHRM1 P11229 1/20 0.51

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
SCHEMBL9632755 0.83 ACHE (0.51) ACHEBCHE
SCHEMBL803462 0.81 CCR3 (0.67) CCR3CXCR4ACHEBCHEALDH1A1
SCHEMBL8880481 0.79 KCNA3 (0.64) CCR3CHRM3CXCR4ACHEBCHE
SCHEMBL8878260 0.79 CHRM3 (0.56) CCR3CHRM3CXCR4ACHEBCHE
SCHEMBL15140944 0.79 CCR3 (0.73) CCR3CXCR4ACHEBCHEALDH1A1
SCHEMBL6362147 0.78 KCNH2 (0.83) CHRM3ACHEKCNH2HRH1ALDH1A1
SCHEMBL6749556 0.78 CCR3 (0.58) CCR3CXCR4ACHEBCHEALDH1A1
SCHEMBL368874 0.78 CCR3 (0.67) CCR3CXCR4ACHEBCHEALDH1A1
SCHEMBL349053 0.77 CCR3 (0.71) CCR3CXCR4ACHEBCHEALDH1A1
SCHEMBL3107807 0.77 CCR3 (0.71) CCR3CXCR4ACHEBCHEALDH1A1

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-0309424-A2 New amidino derivatives ISTITUTO DE ANGELI S.p.A. (IT) 1989-03-29 EP disclosed