SCHEMBL11067274

SCHEMBL11067274

O=C1CCc2c(OCC(O)CN3CCC(CCCCc4ccccc4)CC3)cccc2N1Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 11/20 0.48
ADRB2 P07550 3/20 0.47
ADRB1 P08588 3/20 0.47
ADRB3 P13945 3/20 0.47
DRD4 P21917 2/20 0.47
DRD2 P14416 1/20 0.47
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ATM Q13315 1/20 0.45
KCNH2 Q12809 2/20 0.44

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
SCHEMBL11065039 0.89 DRD4 (0.60) ABCB1ADRB2ADRB1ADRB3DRD4
Oxalic Acid SCHEMBL11071627 0.87 ABCB1 (0.58) ABCB1ADRB2ADRB1ADRB3DRD4
SCHEMBL11061136 0.85 KCNH2 (0.56) ABCB1ADRB2ADRB1ADRB3DRD4
SCHEMBL11066891 0.82 ABCB1 (0.61) ABCB1ADRB2ADRB1ADRB3DRD4
SCHEMBL10570390 0.82 MAPT (0.56) ABCB1MEN1KMT2AKCNH2
Hydrochloric Acid SCHEMBL10570172 0.81 MAPT (0.55) ABCB1MEN1KMT2AKCNH2
SCHEMBL11062798 0.80 CHRM2 (0.60) ADRB2ADRB1DRD4DRD2KCNH2
Oxalic Acid SCHEMBL11067627 0.80 ABCB1 (0.61) ABCB1ADRB2ADRB1ADRB3DRD4
SCHEMBL11066992 0.80 ABCB1 (0.56) ABCB1
SCHEMBL11066890 0.79 ABCB1 (0.57) ABCB1ADRB2ADRB1ADRB3DRD4

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-4482560-A Carbostyril derivatives, and antihistaminic agents containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-11-13 US disclosed