SCHEMBL11258366

SCHEMBL11258366

NC(=O)C1CCN(CCCCOc2ccccc2CCc2ccc(Cl)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 3/20 0.50
▸ LTA4H P09960 1/20 0.49
▸ ABCB1 P08183 4/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ GAA P10253 1/20 0.47
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ CYP2D6 P10635 2/20 0.46
▸ CHRM5 P08912 1/20 0.46
▸ ADRA2A P08913 1/20 0.46
▸ DRD2 P14416 1/20 0.46
▸ ADRA2B P18089 1/20 0.46
▸ ADRA2C P18825 1/20 0.46
▸ DRD1 P21728 1/20 0.46
▸ SLC6A2 P23975 1/20 0.46
▸ ADRA1D P25100 1/20 0.46
▸ HTR2A P28223 1/20 0.46
▸ HTR2C P28335 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
SCHEMBL11259036 0.92 LTA4H (0.55) LTA4HABCB1L3MBTL1KDM4EALDH1A1
SCHEMBL11250630 0.91 KCNH2 (0.53) HRH3LTA4HABCB1L3MBTL1KDM4E
SCHEMBL11260526 0.91 KDM4E (0.50) HRH3LTA4HABCB1L3MBTL1KDM4E
SCHEMBL11252854 0.90 KCNH2 (0.53) HRH3LTA4HL3MBTL1KDM4EALDH1A1
SCHEMBL11260267 0.89 ABCB1 (0.48) HRH3LTA4HABCB1L3MBTL1KDM4E
SCHEMBL11254251 0.89 ABCB1 (0.59) HRH3LTA4HABCB1ALDH1A1DRD2
SCHEMBL11252400 0.89 MEN1 (0.58) HRH3LTA4HABCB1L3MBTL1KDM4E
SCHEMBL11246818 0.88 CYP2D6 (0.48) HRH3ABCB1L3MBTL1KDM4EALDH1A1
SCHEMBL11256008 0.87 KDM4E (0.52) HRH3LTA4HABCB1L3MBTL1KDM4E
SCHEMBL11254264 0.85 LTA4H (0.64) LTA4HABCB1KDM4EALDH1A1MEN1

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 3 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
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
Send feedback