SCHEMBL27906641

SCHEMBL27906641

O=C(C(c1ccccc1)C(O)c1ccccc1)C(c1ccccc1)C(O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2D6 P10635 2/20 0.58
▸ LMNA P02545 4/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ KMT2A Q03164 1/20 0.48
▸ ALDH1A1 P00352 3/20 0.47
▸ ADRA2C P18825 2/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ ADRA2A P08913 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ SRC P12931 2/20 0.46
▸ CES2 O00748 1/20 0.45
▸ CES1 P23141 1/20 0.45
▸ CHRM2 P08172 1/20 0.43
▸ ADRA1A P35348 1/20 0.43
▸ AOC3 Q16853 1/20 0.43
▸ RGS12 O14924 1/20 0.43
▸ GLA P06280 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ PKM P14618 1/20 0.43

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
SCHEMBL27754462 0.88 LMNA (0.49) CYP2D6LMNAMAPK1KMT2AALDH1A1
SCHEMBL5178065 0.86 CYP2D6 (0.73) CYP2D6LMNAMAPK1KMT2AALDH1A1
SCHEMBL30943794 0.79 HDAC3 (0.45) LMNAALDH1A1CES2CES1AOC3
SCHEMBL7575669 0.79 CYP2D6 (0.56) CYP2D6LMNAMAPK1KMT2AALDH1A1
SCHEMBL28048221 0.79 SRC (0.44) CYP2D6LMNAKDM4EHIF1ASRC
SCHEMBL28338447 0.77 FFAR2 (0.47) CYP2D6LMNAKMT2ACES2CES1
SCHEMBL28285858 0.76 CYP2D6 (0.58) CYP2D6LMNAMAPK1KMT2AALDH1A1
SCHEMBL915218 0.76 LMNA (0.62) CYP2D6LMNAMAPK1KMT2AALDH1A1
SCHEMBL29674753 0.76 LMNA (0.62) CYP2D6LMNAMAPK1KMT2AALDH1A1
SCHEMBL3055513 0.76 LMNA (0.62) CYP2D6LMNAMAPK1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108083999-A A kind of environment-friendly preparation method thereof of alpha-alcohol ketone 西北师范大学 2018-05-29 — — CN disclosed
CN-104620177-B Method for improving printing performance of flexographic printing plate 麦克德米德印刷方案股份有限公司 2016-10-19 — — CN disclosed
CN-104626672-A Base material for powder coating and produced panel LANGFARBE POWDER COATINGS CO LTD 2015-05-20 — — CN disclosed
CN-104492670-A Medium density fiberboard powder spraying process LANGFARBE POWDER COATINGS CO LTD 2015-04-08 — — CN disclosed
CN-104508556-A Surface preparation method ARKEMA FRANCE 2015-04-08 — — CN disclosed
CN-103622842-A Delivery particles PROCTER & GAMBLE 2014-03-12 — — CN disclosed
CN-102883803-A Delivery particles PROCTER & GAMBLE 2013-01-16 — — CN disclosed
Send feedback