SCHEMBL410388

SCHEMBL410388

C=C(C)C(=O)OCC(O)COCCCCC

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.60
USP2 O75604 2/20 0.51
LPAR5 Q9H1C0 1/20 0.51
HTT P42858 1/20 0.50
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2C19 P33261 1/20 0.48
THRB P10828 1/20 0.45
PLA2G2C Q5R387 4/20 0.44
SPHK1 Q9NYA1 1/20 0.43
CES2 O00748 1/20 0.42
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
ALOX15 P16050 1/20 0.40
P2RY10 O00398 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
SCHEMBL25134171 0.98 TSHR (0.63) TSHRUSP2LPAR5HTTCYP1A2
SCHEMBL28886809 0.98 TSHR (0.63) TSHRUSP2LPAR5HTTCYP1A2
SCHEMBL2713012 0.95 TSHR (0.53) TSHRUSP2LPAR5HTTCYP1A2
Propene SCHEMBL28109918 0.94 TSHR (0.54) TSHRUSP2LPAR5HTTCYP1A2
SCHEMBL56496 0.94 TSHR (0.53) TSHRUSP2LPAR5HTTCYP1A2
SCHEMBL14919779 0.92 TSHR (0.50) TSHRUSP2LPAR5HTTCYP1A2
SCHEMBL3410733 0.92 TSHR (0.52) TSHRUSP2LPAR5HTTCYP1A2
SCHEMBL15870307 0.92 TSHR (0.52) TSHRUSP2LPAR5HTTCYP1A2
SCHEMBL996289 0.90 TSHR (0.53) TSHRUSP2LPAR5HTTCYP1A2
SCHEMBL11659781 0.90 TSHR (0.53) TSHRUSP2LPAR5HTTCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230350099-A1 SHAPE ENGINEERING OF PARTICLES TO CREATE A NARROW SPECTRAL FILTER AGAINST A SPECIFIC PORTION OF THE LIGHT SPECTRUM THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2023-11-02 US disclosed
US-8637589-B2 Silicone prepolymer solutions JOHNSON & JOHNSON VISION CARE, INC. (US) 2014-01-28 US disclosed
US-8399539-B2 Soluble silicone prepolymers JOHNSON & JOHNSON VISION CARE, INC. (US) 2013-03-19 US disclosed
US-20120065348-A1 SOLUBLE SILICONE PREPOLYMERS TORAY INDUSTRIES, INC. (JP) 2012-03-15 US disclosed
US-20110077322-A1 Silicone Prepolymer Solutions TORAY INDUSTRIES, INC. (JP) 2011-03-31 US disclosed
US-20070054977-A1 Coating composition and method of forming coating film KANSAI PAINT CO., LTD. (JP) 2007-03-08 US disclosed