SCHEMBL11256314

SCHEMBL11256314

O=C(O)C1CCN(CCCCOc2ccccc2CCc2cccc(F)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 12/20 0.54
▸ KDM4E B2RXH2 2/20 0.50
▸ CYP1A2 P05177 1/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ HTR2A P28223 1/20 0.50
▸ BCHE P06276 1/20 0.49
▸ DRD2 P14416 1/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL11247964 0.91 ABCB1 (0.54) ABCB1KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL11258966 0.90 KDM4E (0.56) ABCB1KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL11269080 0.90 MEN1 (0.56) ABCB1KDM4ECYP1A2CYP3A4CYP2D6
Hydrochloric Acid SCHEMBL11260354 0.89 MEN1 (0.55) ABCB1KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL11257645 0.89 ABCB1 (0.56) ABCB1KDM4EDRD2MEN1KMT2A
SCHEMBL11256903 0.89 ABCB1 (0.60) ABCB1KDM4EBCHEDRD2MEN1
SCHEMBL11255351 0.86 KDM4E (0.54) KDM4ECYP1A2CYP3A4CYP2D6HTR2A
SCHEMBL11255705 0.85 ABCB1 (0.49) ABCB1KDM4ECYP1A2CYP2D6DRD2
SCHEMBL11261175 0.84 ABCB1 (0.62) ABCB1DRD2
SCHEMBL11251435 0.83 KDM4E (0.53) ABCB1KDM4ECYP1A2CYP3A4CYP2D6

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
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