SCHEMBL9537288

SCHEMBL9537288

Fc1ccc(Cn2c(CC3CCN(CCc4ccccn4)CC3)nc3ccccc32)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 3/20 0.53
KCNH2 Q12809 4/20 0.51
NR4A2 P43354 1/20 0.51
RAB9A P51151 1/20 0.49
HRH1 P35367 6/20 0.49
CYP2D6 P10635 4/20 0.49
CHRM1 P11229 3/20 0.49
TACR2 P21452 2/20 0.49
TACR1 P25103 2/20 0.49
EED O75530 2/20 0.49
MEN1 O00255 1/20 0.49
MLNR O43193 1/20 0.49
CACNA1F O60840 1/20 0.49
USP2 O75604 1/20 0.49
ABCB11 O95342 1/20 0.49
EGFR P00533 1/20 0.49
LMNA P02545 1/20 0.49
HLA-A P04439 1/20 0.49
ERBB2 P04626 1/20 0.49
TP53 P04637 1/20 0.49

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
Oxalic Acid SCHEMBL10548557 0.95 SSTR5 (0.51) SSTR5KCNH2NR4A2HRH1CYP2D6
Oxalic Acid SCHEMBL10548563 0.95 SSTR5 (0.51) SSTR5KCNH2NR4A2HRH1CYP2D6
SCHEMBL9535970 0.90 SLC6A9 (0.55) SSTR5KCNH2NR4A2LMNATP53
SCHEMBL10548994 0.90 KCNH2 (0.49) SSTR5KCNH2NR4A2HRH1CYP2D6
SCHEMBL9535905 0.89 SSTR5 (0.47) SSTR5KCNH2NR4A2RAB9AHRH1
SCHEMBL9537205 0.85 RAB9A (0.49) SSTR5KCNH2NR4A2RAB9AHRH1
SCHEMBL9539974 0.85 KCNH2 (0.69) SSTR5KCNH2NR4A2RAB9AHRH1
SCHEMBL9537110 0.85 SSTR5 (0.49) SSTR5KCNH2NR4A2RAB9AHRH1
SCHEMBL9537554 0.84 HRH1 (0.63) SSTR5KCNH2NR4A2RAB9AHRH1
SCHEMBL9536663 0.84 RAB9A (0.55) SSTR5KCNH2NR4A2RAB9AHRH1

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-0151826-B1 4-[(Bicyclic heterocyclyl)-methyl and -hetero]-piperidines JANSSEN PHARMACEUTICA N.V. (BE) 1993-03-31 EP disclosed