SCHEMBL11248501

SCHEMBL11248501

Clc1cccc(CCc2ccccc2OCCCCN2CCCC2)c1

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 8/20 0.66
▸ CYP1A2 P05177 1/20 0.57
▸ CYP2D6 P10635 1/20 0.57
▸ CYP2C19 P33261 1/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.57
▸ HRH1 P35367 3/20 0.57
▸ DRD2 P14416 2/20 0.57
▸ DRD1 P21728 1/20 0.57
▸ DRD4 P21917 1/20 0.57
▸ DRD5 P21918 1/20 0.57
▸ DRD3 P35462 1/20 0.57
▸ HRH3 Q9Y5N1 3/20 0.56
▸ KDM4E B2RXH2 1/20 0.56
▸ ALDH1A1 P00352 1/20 0.56

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
SCHEMBL11253990 0.87 L3MBTL1 (0.61) ABCB1CYP1A2CYP2D6CYP2C19L3MBTL1
SCHEMBL11251607 0.86 HRH1 (0.71) ABCB1CYP1A2CYP2D6CYP2C19L3MBTL1
SCHEMBL11257123 0.86 L3MBTL1 (0.60) CYP1A2CYP2D6CYP2C19L3MBTL1HRH1
SCHEMBL11270477 0.85 HRH1 (0.71) ABCB1L3MBTL1HRH1DRD2DRD1
SCHEMBL11256903 0.85 ABCB1 (0.60) ABCB1L3MBTL1DRD2HRH3KDM4E
SCHEMBL11254251 0.84 ABCB1 (0.59) ABCB1DRD2HRH3ALDH1A1
SCHEMBL11252884 0.84 LMNA (0.58) HRH1
SCHEMBL11254277 0.83 L3MBTL1 (0.74) CYP1A2CYP2D6CYP2C19L3MBTL1HRH1
SCHEMBL11257034 0.82 L3MBTL1 (0.72) CYP1A2CYP2D6CYP2C19L3MBTL1HRH1
SCHEMBL11250152 0.81 KCNH2 (0.62) ABCB1CYP1A2CYP2D6CYP2C19L3MBTL1

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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