SCHEMBL28067778

SCHEMBL28067778

COc1cc(C(C)(C)C)c(-c2ccc(O)cc2)c(C(C)(C)C)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
ABL1 P00519 5/20 0.56
ABCB1 P08183 5/20 0.56
BCR P11274 5/20 0.56
ESR2 Q92731 2/20 0.52
GAA P10253 4/20 0.49
ALDH1A1 P00352 2/20 0.49
TTR P02766 2/20 0.46
CYP1A1 P04798 2/20 0.46
ALOX5 P09917 2/20 0.46
PTGS2 P35354 2/20 0.46
CYP1B1 Q16678 2/20 0.46
PDE4A P27815 1/20 0.45
PDE4B Q07343 1/20 0.45
PDE4C Q08493 1/20 0.45
PDE4D Q08499 1/20 0.45
MGAM O43451 2/20 0.44
SI P14410 2/20 0.44
MGAM2 Q2M2H8 2/20 0.44

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
Hydroquinone SCHEMBL7796131 0.83 CA2 (0.84) CA1CA2ABL1ABCB1BCR
SCHEMBL7858676 0.83 TYR (0.54) CA1CA2ABL1ABCB1BCR
SCHEMBL28110292 0.81 LTA4H (0.47) CA1CA2ABL1ABCB1BCR
SCHEMBL2295824 0.81 CA1 (0.67) CA1CA2ABL1ABCB1BCR
SCHEMBL29888641 0.81 CA1 (0.67) CA1CA2ABL1ABCB1BCR
SCHEMBL27526925 0.79 ALDH1A1 (0.54) CA1CA2ESR2ALDH1A1PTGS2
SCHEMBL11751449 0.79 LMNA (0.52) CA1CA2ABL1ABCB1BCR
SCHEMBL28262364 0.79 GAA (0.54) CA1CA2ABL1ABCB1BCR
SCHEMBL28112895 0.78 ALDH1A1 (0.44) CA1CA2ABL1ABCB1BCR
SCHEMBL27789660 0.77 ESR1 (0.40) GAANPC1RAB9AMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102732100-B Transparent topcoat composition and its antihunt means 施乐公司 2019-09-06 CN disclosed
CN-105073939-B Conductive adhesive, anisotropic conductive film, and electronic device using same 昭和电工株式会社 2018-11-09 CN disclosed
CN-103459569-B Lubricant compositions with improved non-Newtonian viscosity behavior 巴斯夫欧洲公司 2018-01-19 CN disclosed
CN-102341187-B Via the method for pre- SOF preparation structures organic film (SOF) 施乐公司 2017-09-29 CN disclosed
CN-102341186-B Electronic devices comprising structured organic films 施乐公司 2017-09-29 CN disclosed
CN-102911553-B Comprise the solid-state phase changes ink composite of oxazoline 施乐公司 2016-12-21 CN disclosed
CN-103748199-B Lubricant compositions having improved antiwear properties 巴斯夫欧洲公司 2016-11-23 CN disclosed
CN-102549124-B The lubricant compositions that comprises alkyl ether carboxylic acid BASF SE (DE) 2016-05-11 CN disclosed