SCHEMBL28065801

SCHEMBL28065801

CC(C)(C)c1ccc(C(=O)O)c(O)c1-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HNF4A P41235 3/20 0.50
ACMSD Q8TDX5 2/20 0.42
LDHA P00338 1/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
GLRA3 O75311 1/20 0.41
GLRB P48167 1/20 0.41
PKM P14618 1/20 0.40
HKDC1 Q2TB90 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PTPN1 P18031 1/20 0.40
SELL P14151 1/20 0.40
SELP P16109 1/20 0.40
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40
PDE4C Q08493 1/20 0.40
PDE4D Q08499 1/20 0.40
AKR1C2 P52895 4/20 0.39

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
SCHEMBL31336614 0.83 FABP4 (0.55) HNF4AACMSDLDHAALDH1A1HPGD
SCHEMBL9817074 0.82 CA2 (0.52) ALDH1A1KDM4EPKMHKDC1L3MBTL1
SCHEMBL8729080 0.80 CSNK1E (0.39) HNF4AACMSDALDH1A1KDM4EHPGD
SCHEMBL19193174 0.78 SELL (0.54) HNF4ALDHAALDH1A1KDM4EHPGD
SCHEMBL14689993 0.77 HNF4A (0.55) HNF4AACMSDLDHAALDH1A1KDM4E
SCHEMBL11026751 0.77 HNF4A (0.58) HNF4AACMSDLDHAALDH1A1KDM4E
SCHEMBL28992365 0.77 BCAT2 (0.44) ALDH1A1KDM4EHPGDHSD17B10L3MBTL1
SCHEMBL30272446 0.76 GLRA3 (0.45) HNF4AACMSDKDM4EGLRA3GLRB
SCHEMBL11876688 0.76 GLRA3 (0.45) HNF4AACMSDKDM4EGLRA3GLRB
SCHEMBL8001214 0.75 HNF4A (0.67) HNF4AACMSDLDHAALDH1A1HSD17B10

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-108559217-A The film and organic electronic device of organic electronic device resin composition for encapsulating 日本瑞翁株式会社 2018-09-21 CN disclosed
CN-105830533-B Sealing film, organic electroluminescent display device and organic semiconductor device 日本瑞翁株式会社 2018-06-01 CN disclosed
CN-104854190-B Resin composition for sealing organic electronic device and organic electronic device 日本瑞翁株式会社 2018-03-23 CN disclosed
CN-104540855-B Catalyst components for the polymerization of olefins 巴塞尔聚烯烃意大利有限公司 2016-08-31 CN disclosed