SCHEMBL3854337

SCHEMBL3854337

C=C(C)C(=O)CC(O)COc1ccc(C(=O)c2ccccc2O)c(O)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.52
LMNA P02545 3/20 0.52
CYP1A2 P05177 2/20 0.52
PGR P06401 2/20 0.52
SLC6A2 P23975 2/20 0.52
CYP2C19 P33261 2/20 0.52
CYP3A4 P08684 1/20 0.52
ADORA3 P0DMS8 1/20 0.52
AR P10275 1/20 0.52
CHRM1 P11229 1/20 0.52
ALOX15 P16050 1/20 0.52
TBXA2R P21731 1/20 0.52
ADRA1A P35348 1/20 0.52
HIF1A Q16665 1/20 0.52
MAOB P27338 8/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
MAOA P21397 6/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP2D6 P10635 1/20 0.40

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
SCHEMBL29590010 0.85 LMNA (0.51) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL428141 0.85 LMNA (0.51) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL1472661 0.84 LMNA (0.52) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL3854343 0.81 HPGD (0.51) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL9417177 0.78 MEN1 (0.43) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL11040659 0.77 LMNA (0.50) LMNACYP2D6ADRB2ADRB1POLB
SCHEMBL29800095 0.77 LMNA (0.49) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL108597 0.77 LMNA (0.49) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL11601476 0.77 LMNA (0.61) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL3766075 0.76 HPGD (0.46) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7576139-B2 Coating composition and method of forming coating film KANSAI PAINT CO., LTD. (JP) 2009-08-18 US disclosed
US-20070054977-A1 Coating composition and method of forming coating film KANSAI PAINT CO., LTD. (JP) 2007-03-08 US disclosed