SCHEMBL11295643

SCHEMBL11295643

C=C(C)C(=O)OC(C)C.C=C(C)C(=O)OCC

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.53
THRB P10828 1/20 0.50
ALDH1A1 P00352 7/20 0.42
GLO1 Q04760 1/20 0.39
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MGAM O43451 1/20 0.38
GAA P10253 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
MAPT P10636 2/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
CASP1 P29466 1/20 0.34
ALOX15 P16050 1/20 0.33

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
Urethane SCHEMBL21483479 0.87 ALOX15 (0.54) TSHRTHRBALDH1A1GLO1LMNA
SCHEMBL10620402 0.86 TSHR (0.52) TSHRTHRBALDH1A1GLO1LMNA
Isopropyl Alcohol SCHEMBL11332211 0.85 TSHR (0.59) TSHRTHRBALDH1A1GLO1LMNA
SCHEMBL15253 0.85
SCHEMBL21772350 0.85 TSHR (0.52) TSHRTHRBALDH1A1LMNAHSD17B10
SCHEMBL19409375 0.85 THRB (0.64) TSHRTHRBALDH1A1GLO1LMNA
SCHEMBL15030 0.85
SCHEMBL719781 0.85 TSHR (0.55) TSHRTHRBALDH1A1LMNAGAA
SCHEMBL11268387 0.84 TSHR (0.46) TSHRTHRBALDH1A1GLO1LMNA
Acrylic Acid Ethyl Ester SCHEMBL6131256 0.84 TSHR (0.46) TSHRTHRBALDH1A1GLO1LMNA

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-4358567-A ZWITTERIONIC ADDITION COPOLYMERS MITSUBISHI PETROCHEMICAL COMPANY LIMITED (JP) 1982-11-09 US claimed
CN-105593715-A Optical laminate NITTO DENKO CORP 2016-05-18 CN disclosed