SCHEMBL8367704

SCHEMBL8367704

CCOCCn1c(C2CCN(CCc3ccc(OC(=O)C(C)C)cc3)CC2)nc2ccccc21

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 13/20 0.69
KCNH2 Q12809 6/20 0.54
CYP2D6 P10635 1/20 0.47
TACR2 P21452 1/20 0.46
TACR1 P25103 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
SCHEMBL28422607 0.92 HRH1 (0.71) HRH1KCNH2CYP2D6
SCHEMBL21359686 0.89 HRH1 (0.71) HRH1KCNH2CYP2D6
SCHEMBL8366151 0.87 HRH1 (0.70) HRH1KCNH2CYP2D6
SCHEMBL18884476 0.86 HRH1 (0.70) HRH1KCNH2CYP2D6
SCHEMBL30307024 0.83 HRH1 (0.79) HRH1KCNH2CYP2D6
SCHEMBL991771 0.83 HRH1 (0.79) HRH1KCNH2CYP2D6
Bilastine SCHEMBL991810 0.83 HRH1 (0.82) HRH1KCNH2CYP2D6
Bilastine SCHEMBL29402994 0.83 HRH1 (0.82) HRH1KCNH2CYP2D6
SCHEMBL28422609 0.82 HRH1 (0.75) HRH1KCNH2CYP2D6
SCHEMBL3793927 0.82 HRH1 (0.79) HRH1KCNH2CYP2D6TACR2TACR1

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
US-5877187-A Benzimidazole derivatives with antihistaminic activity FABRICA ESPANOLA DE PRODUCTOS QUIMICOS Y FARMACEUTICOS S.A. (FAES) (ES) 1999-03-02 US disclosed