SCHEMBL11265533

SCHEMBL11265533

OCCN1CCN(CCCCOc2ccccc2CCc2ccccc2F)CC1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.56
▸ MEN1 O00255 3/20 0.56
▸ KMT2A Q03164 3/20 0.56
▸ ALDH1A1 P00352 2/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ CYP3A4 P08684 1/20 0.56
▸ CYP2D6 P10635 1/20 0.56
▸ CYP2C9 P11712 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56
▸ KCNH2 Q12809 3/20 0.52
▸ ABCB1 P08183 6/20 0.51
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ LMNA P02545 2/20 0.48
▸ HTT P42858 1/20 0.48
▸ DRD2 P14416 1/20 0.47
▸ POLB P06746 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
SCHEMBL11252266 0.88 ALDH1A1 (0.72) KDM4EMEN1KMT2AALDH1A1CYP1A2
SCHEMBL11251525 0.86 SIGMAR1 (0.61) KDM4EMEN1KMT2AALDH1A1KCNH2
SCHEMBL11250769 0.86 KCNH2 (0.62) KDM4EMEN1KMT2AKCNH2ABCB1
SCHEMBL11265539 0.85 KCNH2 (0.66) KDM4EMEN1KMT2AALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL11259169 0.85 KCNH2 (0.62) KDM4EMEN1KMT2AALDH1A1KCNH2
SCHEMBL11261175 0.84 ABCB1 (0.62) KCNH2ABCB1DRD2
SCHEMBL11255280 0.83 KDM4E (0.57) KDM4EMEN1KMT2AALDH1A1KCNH2
SCHEMBL11264264 0.82 ABCB1 (0.53) KDM4EALDH1A1CYP1A2CYP2D6CYP2C19
SCHEMBL11255351 0.82 KDM4E (0.54) KDM4EMEN1KMT2AALDH1A1CYP1A2
SCHEMBL11257614 0.81 KDM4E (0.50) KDM4EMEN1KMT2AALDH1A1CYP1A2

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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