SCHEMBL11270477

SCHEMBL11270477

c1ccc(CCc2ccccc2OCCCCN2CCCCC2)cc1

nearest known ligand 0.71

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 6/20 0.71
DRD1 P21728 3/20 0.69
DRD4 P21917 3/20 0.69
DRD5 P21918 3/20 0.69
DRD3 P35462 3/20 0.69
DRD2 P14416 2/20 0.69
MEN1 O00255 1/20 0.65
KMT2A Q03164 1/20 0.65
KDM4E B2RXH2 2/20 0.64
ALDH1A1 P00352 1/20 0.64
ABCB1 P08183 6/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
SIGMAR1 Q99720 1/20 0.60

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
SCHEMBL11251607 0.99 HRH1 (0.71) HRH1DRD1DRD4DRD5DRD3
SCHEMBL11251197 0.92 HRH1 (0.77) HRH1DRD1DRD4DRD5DRD3
SCHEMBL11256589 0.92 HRH1 (0.72) HRH1DRD1DRD4DRD5DRD3
SCHEMBL11264617 0.91 KCNH2 (0.61) HRH1DRD1DRD4DRD5DRD3
SCHEMBL11257123 0.90 L3MBTL1 (0.60) HRH1DRD1DRD4DRD5DRD3
SCHEMBL11250152 0.90 KCNH2 (0.62) HRH1DRD1DRD4DRD5DRD3
SCHEMBL11253990 0.88 L3MBTL1 (0.61) HRH1DRD1DRD4DRD5DRD3
SCHEMBL11630424 0.88 HRH1 (0.92) HRH1DRD1DRD4DRD5DRD3
SCHEMBL11250769 0.87 KCNH2 (0.62) HRH1DRD1DRD4DRD5DRD3
SCHEMBL11262935 0.87 SIGMAR1 (0.61) HRH1DRD1DRD4DRD5DRD3

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
US-4323568-A INHIBIT PLATELET AGGREGATION MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1982-04-06 US disclosed
EP-0001759-B1 (OMEGA-AMINOALKOXY) BIBENZYLS, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE SUBSTANCES MITSUBISHI KASEI CORPORATION (JP) 1981-12-30 EP disclosed
US-4220603-A ANTICOAGULANTS MITSUBISHI CHEMICAL INDUSTRIES, LIMITED (JP) 1980-09-02 US disclosed
EP-0001759-A1 (Omega-aminoalkoxy) bibenzyls, processes for their preparation and pharmaceutical compositions containing these substances MITSUBISHI KASEI CORPORATION (JP) 1979-05-16 EP disclosed