SCHEMBL21596735

SCHEMBL21596735

CC(C)c1cccc(C(C)C)c1Oc1ccc(-c2[nH]cc(C#N)c2-c2ccccc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
MAT2A P31153 1/20 0.34
KDM5A P29375 2/20 0.33
LRRK2 Q5S007 2/20 0.33
GAA P10253 2/20 0.33
CYP1A2 P05177 1/20 0.33
MCL1 Q07820 1/20 0.33
KDM6B O15054 1/20 0.32
KDM5C P41229 1/20 0.32
KDM5D Q9BY66 1/20 0.32
KDM4C Q9H3R0 1/20 0.32
KDM5B Q9UGL1 1/20 0.32
PHF8 Q9UPP1 1/20 0.32
MDM2 Q00987 1/20 0.32
PDE4A P27815 2/20 0.32
PDE4B Q07343 2/20 0.32
PDE4C Q08493 2/20 0.32
PDE4D Q08499 2/20 0.32

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
SCHEMBL21596731 0.82 KMT2A (0.40) ALDH1A1HPGDGAACYP1A2PDE10A
SCHEMBL193826 0.77 LRRK2 (0.47) ALDH1A1HPGDLRRK2MCL1MDM2
SCHEMBL21608897 0.75 PPARA (0.36)
SCHEMBL21596734 0.70 PGR (0.43) ARPDE4APDE4BPDE4CPDE4D
SCHEMBL4141536 0.69 AR (0.51) ARALDH1A1HPGDPDE4B
SCHEMBL11583313 0.69 LTA4H (0.46) ALDH1A1HPGDCYP1A2MCL1MEN1
SCHEMBL12670780 0.64 CHUK (0.47) ALDH1A1HPGDLRRK2GAACYP1A2
SCHEMBL194530 0.64 LRRK2 (0.46) ALDH1A1HPGDLRRK2GAACYP1A2
SCHEMBL22096799 0.63 AR (0.37) ARALDH1A1HPGDCYP1A2POLB
SCHEMBL19322496 0.62 AR (0.52) ARALDH1A1HPGDGAAMCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112292436-B Extruded PET film with light stable dye for color conversion 巴斯夫欧洲公司 2024-12-10 CN disclosed
EP-3810720-B1 EXTRUDED PET FILMS WITH PHOTOSTABLE DYES FOR COLOR CONVERSION BASF SE (DE) 2022-08-10 EP disclosed
EP-3810720-A1 EXTRUDED PET FILMS WITH PHOTOSTABLE DYES FOR COLOR CONVERSION BASF SE (DE) 2021-04-28 EP disclosed
WO-2019243288-A1 EXTRUDED PET FILMS WITH PHOTOSTABLE DYES FOR COLOR CONVERSION BASF SE (DE) 2019-12-26 WO disclosed