SCHEMBL11070828

SCHEMBL11070828

O=C1CCc2c(OCCN3CCC(O)(c4ccccc4)CC3)cccc2N1Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 1/20 0.47
HTR6 P50406 2/20 0.47
POLB P06746 2/20 0.46
TACR1 P25103 1/20 0.45
SIGMAR1 Q99720 1/20 0.44
CCR3 P51677 1/20 0.42

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
SCHEMBL11066992 0.85 ABCB1 (0.56) OPRL1POLB
SCHEMBL11065111 0.85 SIGMAR1 (0.53) SIGMAR1CCR3
SCHEMBL10575317 0.82 SIGMAR1 (0.54) HTR6SIGMAR1
SCHEMBL11072709 0.82 MEN1 (0.47) OPRL1SIGMAR1
SCHEMBL10568199 0.78 SIGMAR1 (0.58) SIGMAR1
SCHEMBL11069074 0.77 HTR7 (0.46) OPRL1SIGMAR1
SCHEMBL11062798 0.77 CHRM2 (0.60) HTR6
SCHEMBL11070274 0.76 CHRM1 (0.55) HTR6SIGMAR1
SCHEMBL10572966 0.76 DRD2 (0.52) SIGMAR1
SCHEMBL11729211 0.74 HTR6 (0.48) HTR6POLB

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