SCHEMBL13688299

SCHEMBL13688299

COC(=O)[C@H]1C2CC([C@@H](C)[C@@H]2C(=O)OCc2ccc(OC)cc2)[C@H]1C

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FABP7 O15540 1/20 0.51
▸ FABP5 Q01469 1/20 0.51
▸ ALDH1A1 P00352 5/20 0.51
▸ HTT P42858 4/20 0.51
▸ HPGD P15428 2/20 0.51
▸ GLA P06280 1/20 0.51
▸ MAPT P10636 1/20 0.42
▸ MIF P14174 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ ATM Q13315 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ KMT2A Q03164 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
SCHEMBL10119916 1.00 FABP7 (0.51) FABP7FABP5ALDH1A1HTTHPGD
SCHEMBL6737480 1.00 FABP7 (0.51) FABP7FABP5ALDH1A1HTTHPGD
SCHEMBL6737702 1.00 FABP7 (0.51) FABP7FABP5ALDH1A1HTTHPGD
SCHEMBL10119915 1.00 FABP7 (0.51) FABP7FABP5ALDH1A1HTTHPGD
SCHEMBL6736507 0.96 ALDH1A1 (0.50) FABP7FABP5ALDH1A1HTTHPGD
SCHEMBL10119919 0.96 ALDH1A1 (0.50) FABP7FABP5ALDH1A1HTTHPGD
SCHEMBL14827601 0.92 FABP7 (0.53) FABP7FABP5ALDH1A1HTTHPGD
SCHEMBL14827600 0.92 FABP7 (0.53) FABP7FABP5ALDH1A1HTTHPGD
SCHEMBL6737709 0.92 FABP7 (0.55) FABP7FABP5ALDH1A1HTTHPGD
SCHEMBL10119917 0.92 FABP7 (0.55) FABP7FABP5ALDH1A1HTTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7595368-B2 Nanofilm compositions with polymeric components COVALENT PARTNERS, LLC (US) 2009-09-29 — — US disclosed
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