SCHEMBL11487359

SCHEMBL11487359

Fc1ccc(Cn2c(NC3CCN(CCc4ccncc4)CC3)nc3ccccc32)cc1

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 8/20 0.87
KCNH2 Q12809 10/20 0.83
NR4A2 P43354 2/20 0.83
EED O75530 2/20 0.79
HRH1 P35367 2/20 0.79
HRH4 Q9H3N8 2/20 0.79
MEN1 O00255 1/20 0.79
MLNR O43193 1/20 0.79
CACNA1F O60840 1/20 0.79
USP2 O75604 1/20 0.79
ABCB11 O95342 1/20 0.79
EGFR P00533 1/20 0.79
LMNA P02545 1/20 0.79
HLA-A P04439 1/20 0.79
ERBB2 P04626 1/20 0.79
TP53 P04637 1/20 0.79
CYP1A2 P05177 1/20 0.79
LCK P06239 1/20 0.79
FYN P06241 1/20 0.79
CHRM2 P08172 1/20 0.79

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
SCHEMBL10428997 0.91 SSTR5 (0.89) SSTR5KCNH2NR4A2EEDHRH1
Desmetheylastemizole SCHEMBL1152697 0.91 KCNH2 (1.00) SSTR5KCNH2NR4A2EEDHRH1
SCHEMBL11571595 0.91 SSTR5 (0.87) SSTR5KCNH2NR4A2EEDHRH1
SCHEMBL9580736 0.91 SSTR5 (0.87) SSTR5KCNH2NR4A2EEDHRH1
Desmetheylastemizole SCHEMBL29601510 0.91 KCNH2 (1.00) SSTR5KCNH2NR4A2EEDHRH1
Desmetheylastemizole SCHEMBL11473376 0.90 KCNH2 (0.98) SSTR5KCNH2NR4A2EEDHRH1
Desmetheylastemizole SCHEMBL11473379 0.90 KCNH2 (0.98) SSTR5KCNH2NR4A2EEDHRH1
SCHEMBL9629452 0.89 SSTR5 (0.91) SSTR5KCNH2NR4A2EEDHRH1
SCHEMBL20133301 0.88 KCNH2 (0.84) SSTR5KCNH2NR4A2EEDHRH1
Astemizole SCHEMBL4385 0.88 KCNH2 (1.00) SSTR5KCNH2NR4A2EEDHRH1

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
US-4219559-A N-Heterocyclyl-4-piperidinamines JANSSEN PHARMACEUTICA N.V. (BE) 1980-08-26 US disclosed
EP-0005318-A1 N-Heterocyclyl-4-piperidinamines, methods for their preparation, pharmaceutical compositions comprising them, intermediates therefor, and method for the preparation of the intermediates JANSSEN PHARMACEUTICA N.V. (BE) 1979-11-14 EP disclosed