SCHEMBL9535231

SCHEMBL9535231

Fc1ccc(Cn2c(CC3CCN(CCCOc4ccc(F)cc4)CC3)nc3ccccc32)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.52
SSTR5 P35346 3/20 0.51
TACR2 P21452 2/20 0.51
TACR1 P25103 2/20 0.51
HRH1 P35367 2/20 0.51
TMEM97 Q5BJF2 2/20 0.51
SIGMAR1 Q99720 2/20 0.51
EED O75530 2/20 0.51
MEN1 O00255 1/20 0.51
MLNR O43193 1/20 0.51
CACNA1F O60840 1/20 0.51
USP2 O75604 1/20 0.51
ABCB11 O95342 1/20 0.51
EGFR P00533 1/20 0.51
LMNA P02545 1/20 0.51
HLA-A P04439 1/20 0.51
ERBB2 P04626 1/20 0.51
TP53 P04637 1/20 0.51
CYP1A2 P05177 1/20 0.51
LCK P06239 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
SCHEMBL9539669 0.87 RAB9A (0.52) HRH3SSTR5TACR2TACR1HRH1
SCHEMBL9537205 0.86 RAB9A (0.49) HRH3SSTR5TACR2TACR1HRH1
Hydrochloric Acid SCHEMBL9537670 0.85 RAB9A (0.55) HRH3SSTR5TACR2TACR1HRH1
SCHEMBL9536663 0.85 RAB9A (0.55) HRH3SSTR5TACR2TACR1HRH1
SCHEMBL9537554 0.85 HRH1 (0.63) HRH3SSTR5TACR2TACR1HRH1
SCHEMBL9540175 0.85 KCNH2 (0.71) HRH3SSTR5TACR2TACR1HRH1
SCHEMBL9536904 0.85 RAB9A (0.50) HRH3SSTR5TACR2TACR1HRH1
SCHEMBL9536935 0.84 NPSR1 (0.55) SSTR5HRH1CYP2D6MAPTCHRM1
Hydrochloric Acid SCHEMBL9539517 0.84 HRH1 (0.62) HRH3SSTR5TACR2TACR1HRH1
SCHEMBL9536543 0.84 SSTR5 (0.66) SSTR5HRH1MEN1ABCB11LMNA

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 4 patents. 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
US-4839374-A TREATING ALLERGIES JANSSEN PHARMACEUTICA, N.V. (BE) 1989-06-13 US disclosed
US-4695575-A ANTIHISTAMINES JANSSEN PHARMACEUTICA, N.V. (BE) 1987-09-22 US disclosed
EP-0151826-A1 4-[(Bicyclic heterocyclyl)-methyl and -hetero]-piperidines JANSSEN PHARMACEUTICA N.V. (BE) 1985-08-21 EP disclosed