SCHEMBL4359174

SCHEMBL4359174

C=C(CCCOCCOC)C(=O)O.C=C(CCCOCCOCC)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.40
EPHX2 P34913 6/20 0.38
ALDH1A1 P00352 2/20 0.36
TSHR P16473 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
HPGD P15428 2/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
KDM4E B2RXH2 1/20 0.34
TBXAS1 P24557 1/20 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
SCHEMBL5569902 0.93 ALDH1A1 (0.41) THRBEPHX2ALDH1A1TSHRSMN1; SMN2
SCHEMBL289015 0.93 THRB (0.44) THRBEPHX2ALDH1A1TSHRSMN1; SMN2
SCHEMBL33440 0.93 ALDH1A1 (0.39) EPHX2ALDH1A1TSHRSMN1; SMN2HPGD
SCHEMBL2229640 0.93 ALDH1A1 (0.39) EPHX2ALDH1A1TSHRSMN1; SMN2HPGD
SCHEMBL7256040 0.93 THRB (0.44) THRBEPHX2ALDH1A1TSHRSMN1; SMN2
SCHEMBL33661 0.93 THRB (0.44) THRBEPHX2ALDH1A1TSHRSMN1; SMN2
SCHEMBL33745 0.89 THRB (0.42) THRBEPHX2ALDH1A1TSHRSMN1; SMN2
Methacrylic Acid SCHEMBL4830706 0.88 THRB (0.49) THRBEPHX2ALDH1A1TSHRSMN1; SMN2
SCHEMBL7531172 0.88 THRB (0.41) THRBEPHX2ALDH1A1TSHRSMN1; SMN2
SCHEMBL8928146 0.86 ALDH1A1 (0.50) THRBEPHX2ALDH1A1TSHRSMN1; SMN2

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-7510769-B2 Laminate film NIPPON BEE CHEMICAL CO., LTD. (JP) 2009-03-31 US disclosed
US-20050202266-A1 Laminate film NIPPON PAINT AUTOMOTIVE COATINGS CO., LTD (JP) 2005-09-15 US disclosed