SCHEMBL11259795

SCHEMBL11259795

NC(=O)C1CCCN(CCCOc2ccccc2CCc2ccccc2)C1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.54
KDM4E B2RXH2 4/20 0.53
KMT2A Q03164 3/20 0.53
CHRNB2 P17787 2/20 0.52
CHRNB4 P30926 2/20 0.52
CHRNA3 P32297 2/20 0.52
CHRNA4 P43681 2/20 0.52
HRH1 P35367 4/20 0.52
MEN1 O00255 2/20 0.52
DRD2 P14416 1/20 0.51
DRD1 P21728 1/20 0.51
DRD4 P21917 1/20 0.51
DRD5 P21918 1/20 0.51
DRD3 P35462 1/20 0.51
LTA4H P09960 1/20 0.51
ALDH1A1 P00352 1/20 0.50
GAA P10253 1/20 0.49
ABCB1 P08183 1/20 0.49

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
SCHEMBL11256970 0.97 KDM4E (0.54) L3MBTL1KDM4EKMT2ACHRNB2CHRNB4
SCHEMBL11255291 0.94 LTA4H (0.58) L3MBTL1KDM4EKMT2ACHRNB2CHRNB4
SCHEMBL11252400 0.87 MEN1 (0.58) L3MBTL1KDM4EKMT2AHRH1MEN1
SCHEMBL8773759 0.85 LTA4H (0.64) KMT2AHRH1DRD2DRD1DRD4
SCHEMBL11259036 0.84 LTA4H (0.55) L3MBTL1KDM4EKMT2AHRH1MEN1
SCHEMBL11254264 0.82 LTA4H (0.64) KDM4EKMT2AHRH1MEN1DRD2
SCHEMBL2450443 0.81 KMT2A (0.60) KDM4EKMT2AMEN1DRD3LTA4H
SCHEMBL7135531 0.80 LTA4H (0.78) KDM4ELTA4HALDH1A1
SCHEMBL11256589 0.80 HRH1 (0.72) L3MBTL1KDM4EHRH1DRD2DRD1
SCHEMBL11250630 0.78 KCNH2 (0.53) L3MBTL1KDM4EHRH1DRD2DRD1

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