SCHEMBL7433044

SCHEMBL7433044

O=C(CCl)O[C@H]1CCCC[C@@H]1c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FABP5 Q01469 6/20 0.57
▸ FABP7 O15540 4/20 0.57
▸ FABP3 P05413 3/20 0.57
▸ SLC18A3 Q16572 4/20 0.44
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ MITF O75030 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ PAX8 Q06710 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ TACR1 P25103 1/20 0.42
▸ SSTR4 P31391 1/20 0.40
▸ KCNQ3 O43525 1/20 0.39
▸ KCNQ2 O43526 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ SLC6A2 P23975 1/20 0.39
▸ SLC6A4 P31645 1/20 0.39

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
SCHEMBL7433049 1.00 FABP5 (0.57) FABP5FABP7FABP3SLC18A3MEN1
SCHEMBL7433046 1.00 FABP5 (0.57) FABP5FABP7FABP3SLC18A3MEN1
SCHEMBL6858142 0.86 FABP5 (0.58) FABP5FABP7FABP3SLC18A3MEN1
SCHEMBL9370830 0.86 FABP5 (0.58) FABP5FABP7FABP3SLC18A3MEN1
SCHEMBL28635740 0.85 FABP5 (0.57) FABP5FABP7FABP3SLC18A3MEN1
SCHEMBL28635739 0.85 FABP5 (0.57) FABP5FABP7FABP3SLC18A3MEN1
SCHEMBL27688008 0.85 FABP5 (0.57) FABP5FABP7FABP3SLC18A3MEN1
SCHEMBL28644515 0.85 FABP5 (0.57) FABP5FABP7FABP3SLC18A3MEN1
SCHEMBL12194937 0.83 FABP5 (0.61) FABP5FABP7FABP3SLC18A3MEN1
SCHEMBL25369789 0.82 FABP5 (0.64) FABP5FABP7FABP3SLC18A3MEN1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0343474-A2 Process for the preparation of optically pure aminophenylthio- and aminoaphthalenylthio-propanoic acids F. HOFFMANN-LA ROCHE AG (CH) 1989-11-29 — — EP claimed
EP-0759021-A1 PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE 2-ARYLCYCLOHEXANOLS HOECHST CELANESE CORPORATION (US) 1997-02-26 — — EP disclosed
WO-1995031424-A1 PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE 2-ARYLCYCLOHEXANOLS HOECHST CELANESE CORPORATION (US) 1995-11-23 — — WO disclosed
US-5420366-A Hydrogenolysis HOECHST CELANESE CORPORATION (US) 1995-05-30 — — US disclosed
EP-0343474-A2 Process for the preparation of optically pure aminophenylthio- and aminoaphthalenylthio-propanoic acids F. HOFFMANN-LA ROCHE AG (CH) 1989-11-29 — — EP disclosed
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