SCHEMBL8993677

SCHEMBL8993677

C=C(C)C(=O)OCCCOc1ccc(C(=O)c2ccccc2O)c(O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.54
LMNA P02545 1/20 0.54
CYP1A2 P05177 1/20 0.54
PGR P06401 1/20 0.54
CYP3A4 P08684 1/20 0.54
ADORA3 P0DMS8 1/20 0.54
AR P10275 1/20 0.54
CHRM1 P11229 1/20 0.54
ALOX15 P16050 1/20 0.54
TBXA2R P21731 1/20 0.54
SLC6A2 P23975 1/20 0.54
CYP2C19 P33261 1/20 0.54
ADRA1A P35348 1/20 0.54
HIF1A Q16665 1/20 0.54
POLB P06746 3/20 0.49
TDP1 Q9NUW8 2/20 0.49
APEX1 P27695 1/20 0.49
HTT P42858 1/20 0.49
PPARD Q03181 1/20 0.48
MAOB P27338 12/20 0.45

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
SCHEMBL93256 0.94 HPGD (0.56) HPGDLMNACYP1A2PGRCYP3A4
SCHEMBL381637 0.92 LMNA (0.52) HPGDLMNACYP1A2PGRCYP3A4
SCHEMBL380884 0.90 HPGD (0.54) HPGDLMNACYP1A2PGRCYP3A4
SCHEMBL4194204 0.89 HPGD (0.58) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL38659958 0.89 HPGD (0.58) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL18224153 0.87 NPC1 (0.50) HPGDLMNACYP1A2PGRCYP3A4
SCHEMBL93611 0.87 HPGD (0.58) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL29384629 0.87 HPGD (0.58) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL27708180 0.86 HTT (0.59) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL27590735 0.86 HTT (0.59) HPGDLMNACYP1A2PGRSLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0465034-B1 Photosensitive resin composition for flexographic printing NIPPON PAINT CO LTD (JP) 1996-08-14 EP disclosed
EP-0570992-A1 Powder coatings NIPPON PAINT CO., LTD. (JP) 1993-11-24 EP disclosed
EP-0465034-A1 Photosensitive resin composition for flexographic printing NIPPON PAINT CO., LTD. (JP) 1992-01-08 EP disclosed
US-5034432-A Thermosetting or thermoplastic resins for powder coatings NIPPON PAINT CO., LTD. (JP) 1991-07-23 US disclosed
EP-0389080-A1 Powder coatings NIPPON PAINT CO., LTD. (JP) 1990-09-26 EP disclosed