SCHEMBL8526201

SCHEMBL8526201

C=CC(=O)NC(CCC)OCC

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.37
ZDHHC2 Q9UIJ5 1/20 0.37
ACACB O00763 2/20 0.37
TAS1R3 Q7RTX0 4/20 0.35
TAS1R1 Q7RTX1 4/20 0.35
ALDH1A1 P00352 2/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
TGM2 P21980 1/20 0.32
HPGD P15428 1/20 0.32
CTSK P43235 1/20 0.31
CYP2C19 P33261 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HDAC9 Q9UKV0 1/20 0.31
HDAC5 Q9UQL6 1/20 0.31
PLA2G2C Q5R387 1/20 0.30

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
SCHEMBL6580192 0.85 TSHR (0.47) TSHRZDHHC20ZDHHC2ACACBALDH1A1
SCHEMBL28531165 0.85 TSHR (0.47) TSHRZDHHC20ZDHHC2ACACBTAS1R3
SCHEMBL660975 0.84 TSHR (0.45) TSHRZDHHC20ZDHHC2ACACBALDH1A1
SCHEMBL2847929 0.84 TSHR (0.45) TSHRZDHHC20ZDHHC2ACACBTAS1R3
SCHEMBL18613474 0.79 TSHR (0.41) TSHRZDHHC20ZDHHC2ACACBTAS1R3
SCHEMBL9138939 0.79 TSHR (0.41) TSHRZDHHC20ZDHHC2ACACBTAS1R3
SCHEMBL1305178 0.79 ALDH1A1 (0.39) TSHRZDHHC20ZDHHC2TAS1R3TAS1R1
SCHEMBL20530421 0.78 TSHR (0.40) TSHRZDHHC20ZDHHC2ACACBTAS1R3
SCHEMBL10781835 0.78 TSHR (0.40) TSHRZDHHC20ZDHHC2ACACBTAS1R3
SCHEMBL7156362 0.78 TSHR (0.44) TSHRZDHHC20ZDHHC2ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5977242-A Two-part emulsion adhesive KONISHI CO., LTD. (JP) 1999-11-02 US disclosed
EP-0599295-B1 Two-part type emulsion adhesive KONISHI CO LTD (JP) 1999-01-27 EP disclosed
EP-0599295-A1 Two-part type emulsion adhesive KONISHI CO., LTD. (JP) 1994-06-01 EP disclosed