SCHEMBL6003827

SCHEMBL6003827

O=C(O)c1cccc(Oc2ccccc2C(F)(c2ccccc2Oc2cccc(C(=O)O)c2C(=O)O)C(F)(F)C(F)(F)F)c1C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.40
TAS2R14 Q9NYV8 2/20 0.36
FABP4 P15090 1/20 0.36
KDM4E B2RXH2 4/20 0.36
HPGD P15428 4/20 0.36
HSD17B10 Q99714 4/20 0.36
ALDH1A1 P00352 4/20 0.36
ESR1 P03372 1/20 0.36
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
HMGB1 P09429 1/20 0.36
TSHR P16473 1/20 0.36
GGT1 P19440 1/20 0.36
PTGS1 P23219 1/20 0.36
PTGS2 P35354 1/20 0.36
BLM P54132 1/20 0.36
NAPRT Q6XQN6 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35

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
SCHEMBL1078673 0.86 HTT (0.42) HTTTAS2R14FABP4KDM4EHPGD
SCHEMBL29088055 0.86 MRGPRX4 (0.46) HTTTAS2R14FABP4ALDH1A1MRGPRX4
SCHEMBL3423138 0.82 TAS2R14 (0.40) TAS2R14FABP4KDM4EHPGDHSD17B10
SCHEMBL29640973 0.80 HTT (0.47) HTTKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL1079649 0.80 HTT (0.47) HTTKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL29962758 0.80 HTT (0.41) HTTTAS2R14FABP4KDM4EHPGD
SCHEMBL28384429 0.80 POLB (0.39) KDM4EALDH1A1TDP1CA12CA1
SCHEMBL6003587 0.79 HTT (0.59) HTTKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL143861 0.79 HTT (0.53) HTTKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL29395127 0.79 HTT (0.53) HTTKDM4EHPGDHSD17B10ALDH1A1

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
CN-114747035-A Support substrate for display device, organic EL display device, and method for manufacturing organic EL display device 株式会社LG化学 2022-07-12 CN disclosed
US-7092608-B2 Polyimide optical materials, polyimide precursor solutions and optical waveguide elements KABUSHIKI KAISHA TOSHIBA (JP) 2006-08-15 US disclosed
US-7082244-B2 Polyimide optical materials, polyimide precursor solutions and optical waveguide elements KABUSHIKI KAISHA TOSHIBA (JP) 2006-07-25 US disclosed
US-20060159413-A1 POLYIMIDE OPTICAL MATERIALS, POLYIMIDE PRECURSOR SOLUTIONS AND OPTICAL WAVEGUIDE ELEMENTS KABUSHIKI KAISHA TOSHIBA (JP) 2006-07-20 US disclosed
US-20040197064-A1 Polyimide optical materials, polyimide precursor solutions and optical waveguide elements KABUSHIKI KAISHA TOSHIBA (JP) 2004-10-07 US disclosed