SCHEMBL27598712

SCHEMBL27598712

CC(C)C1(O)CCC(C)(c2ccccc2)C(c2ccccc2)(c2ccccc2)C1(O)O

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ OPRM1 P35372 10/20 0.36
▸ OPRL1 P41146 9/20 0.36
▸ OPRK1 P41145 8/20 0.36
▸ OPRD1 P41143 6/20 0.36
▸ CYP2D6 P10635 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.31
▸ MMP1 P03956 1/20 0.31
▸ MMP2 P08253 1/20 0.31
▸ MMP9 P14780 1/20 0.31
▸ GRIN2D O15399 1/20 0.31
▸ GRIN3B O60391 1/20 0.31
▸ GRIN1 Q05586 1/20 0.31
▸ KCNH2 Q12809 1/20 0.31
▸ GRIN2A Q12879 1/20 0.31
▸ GRIN2B Q13224 1/20 0.31
▸ GRIN2C Q14957 1/20 0.31
▸ GRIN3A Q8TCU5 1/20 0.31
▸ CYP1A2 P05177 1/20 0.30

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
SCHEMBL28071759 0.89 OPRM1 (0.36) OPRM1OPRL1OPRK1OPRD1CYP2D6
SCHEMBL28287428 0.84 CYP2D6 (0.35) OPRM1OPRL1OPRK1OPRD1CYP2D6
SCHEMBL30312220 0.70 OPRM1 (0.50) OPRM1OPRL1OPRK1ALDH1A1
SCHEMBL16880857 0.67 AKR1C1 (0.42) OPRM1OPRL1OPRK1OPRD1CYP2D6
SCHEMBL16880433 0.66 OPRM1 (0.39) OPRM1OPRL1OPRK1OPRD1CYP2D6
SCHEMBL28208193 0.65 CCR2 (0.33) OPRM1OPRL1OPRK1OPRD1
SCHEMBL28208190 0.65 OPRL1 (0.34) OPRM1OPRL1OPRK1CYP2D6
SCHEMBL28220933 0.62 OPRL1 (0.35) OPRL1CYP2D6
SCHEMBL8611829 0.62 OPRM1 (0.40) OPRM1OPRL1OPRK1ALDH1A1
SCHEMBL27278255 0.62 OPRM1 (0.40) OPRM1OPRL1OPRK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108291122-A Anionic curable composition 设计分子有限公司 2018-07-17 — — CN claimed
CN-106378087-B The preparation method of nano composite adsorption material, adsorbent and processing method for handling trihydroxy triphenylmenthane substance in waste water 重庆大学 2018-07-20 — — CN disclosed
CN-106378087-B The preparation method of nano composite adsorption material, adsorbent and processing method for handling trihydroxy triphenylmenthane substance in waste water 重庆大学 2018-07-20 — — CN disclosed
CN-106378087-B The preparation method of nano composite adsorption material, adsorbent and processing method for handling trihydroxy triphenylmenthane substance in waste water 重庆大学 2018-07-20 — — CN disclosed
CN-108291122-A Anionic curable composition 设计分子有限公司 2018-07-17 — — CN disclosed
CN-102791487-B Lithographic printing plate precursor and method for manufacturing lithographic printing plate AGFA GRAPHICS NV 2014-12-03 — — CN disclosed
CN-102791487-A A lithographic printing plate precursor AGFA GRAPHICS NV 2012-11-21 — — CN disclosed
CN-101980873-B Method for treating lithographic printing plate AGFA GRAPHICS NV 2012-05-30 — — CN disclosed
CN-101980873-A Method for treating lithographic printing plate AGFA GRAPHICS NV 2011-02-23 — — CN disclosed
CN-101855026-A Method of drying coating film and process for producing lithographic printing plate precursor FUJIFILM CORP 2010-10-06 — — CN disclosed
CN-1608862-B Positive lithographic printing plate precursor AIKFA GHFAT S A 2010-04-28 — — CN disclosed
CN-100556692-C Heat-sensitive lithographic printing plate precursor AGFA GEVAERT (BE) 2009-11-04 — — CN disclosed
CN-101405147-A Method for making a lithographic printing plate AGFA GRAPHICS NV (BE) 2009-04-08 — — CN disclosed
CN-101237991-A Infrared absorbing dye AGFA GEVAERT (BE) 2008-08-06 — — CN disclosed
CN-1767949-A Heat-sensitive lithographic printing plate precursor AGFA GEVAERT (BE) 2006-05-03 — — CN disclosed
CN-1608862-A Positive lithographic printing plate precursor AIKFA GHFAT S A (BE) 2005-04-27 — — CN disclosed
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