SCHEMBL3108005

SCHEMBL3108005

C=CCCCCCCCC(C#N)CCC

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
ALDH1A1 P00352 4/20 0.43
USP2 O75604 3/20 0.34
MAPT P10636 2/20 0.34
CYP3A4 P08684 1/20 0.34
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TRPA1 O75762 2/20 0.33
PTGS1 P23219 1/20 0.33
PPARG P37231 1/20 0.33
OPRK1 P41145 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33
LMNA P02545 1/20 0.32
ABCC4 O15439 1/20 0.31

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
SCHEMBL3127320 1.00 TSHR (0.50) TSHRALDH1A1USP2MAPTCYP3A4
SCHEMBL3112131 1.00 TSHR (0.50) TSHRALDH1A1USP2MAPTCYP3A4
SCHEMBL3116402 0.98 TSHR (0.46) TSHRALDH1A1USP2MAPTCYP3A4
SCHEMBL3124622 0.92 TSHR (0.56) TSHRALDH1A1USP2MAPTCYP3A4
SCHEMBL31590958 0.92 TSHR (0.61) TSHRALDH1A1USP2MAPTCYP3A4
SCHEMBL4354554 0.92 TSHR (0.61) TSHRALDH1A1USP2MAPTCYP3A4
SCHEMBL3118524 0.92 TSHR (0.56) TSHRALDH1A1USP2MAPTCYP3A4
SCHEMBL3112778 0.92 TSHR (0.56) TSHRALDH1A1USP2MAPTCYP3A4
SCHEMBL3112743 0.92 TSHR (0.46) TSHRALDH1A1
SCHEMBL3108944 0.90 TSHR (0.52) TSHRALDH1A1USP2MAPTCYP3A4

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
US-7714087-B2 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition containing the copolymer, and uses thereof MITSUI CHEMICALS, INC. (JP) 2010-05-11 US disclosed
EP-1734061-B1 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition containing the copolymer and uses thereof MITSUI CHEMICALS INC (JP) 2010-04-07 EP disclosed
US-20090137757-A1 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition containing the copolymer, and uses thereof IMUTA JUNICHI 2009-05-28 US disclosed
US-7393907-B2 Polar group-containing olefin copolymer, process for preparing the same, thermoplastic resin composition containing the copolymer, and uses thereof MITSUI CHEMICALS, INC. (JP) 2008-07-01 US disclosed