SCHEMBL13385083

SCHEMBL13385083

CC(COc1ccc(C2(c3ccc(OCC4CO4)cc3)CCCCC2)cc1)COc1ccc(C2(c3ccc(OCC4CO4)cc3)CCCCC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.46
▸ TP53 P04637 3/20 0.46
▸ TSHR P16473 3/20 0.46
▸ MAPT P10636 2/20 0.46
▸ HPGD P15428 2/20 0.46
▸ MEN1 O00255 2/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ HIF1A Q16665 2/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ PPARG P37231 1/20 0.46
▸ TDP1 Q9NUW8 2/20 0.44
▸ PKM P14618 2/20 0.43
▸ LMNA P02545 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ PSMB1 P20618 1/20 0.42
▸ PSMB5 P28074 1/20 0.42
▸ PSMB2 P49721 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ ADORA3 P0DMS8 1/20 0.36

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
SCHEMBL13385077 0.99 ALDH1A1 (0.47) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL5598711 0.89 TDP1 (0.54) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL24394464 0.89 TDP1 (0.54) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL14969345 0.89 TDP1 (0.54) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL13385076 0.89 ALDH1A1 (0.45) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL16377120 0.87 TDP1 (0.44) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL18230811 0.85 HPGD (0.42) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL18230814 0.85 PKM (0.57) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL21514937 0.83 TDP1 (0.40) ALDH1A1TP53TSHRMAPTHPGD
SCHEMBL13514846 0.82 PSMB1 (0.43) ALDH1A1TP53TSHRMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7695895-B2 photopolymerizable unsaturated binder obtained by adding unsaturated monobasic acid polyfunctional epoxy resin to form epoxy adduct and allowing epoxy adduct and polybasic acid anhydride to react; color filters, liquid crystal displays, image sensors TOPPAN PRINTING CO., LTD. (JP) 2010-04-13 — — US disclosed
US-20070292805-A1 photopolymerizable unsaturated binder obtained by adding unsaturated monobasic acid polyfunctional epoxy resin to form epoxy adduct and allowing epoxy adduct and polybasic acid anhydride to react; color filters, liquid crystal displays, image sensors ADEKA CORPORATION (JP) 2007-12-20 — — US disclosed
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