SCHEMBL29520375

SCHEMBL29520375

C=CC(=O)NCCC(O)CCC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.55
ZDHHC2 Q9UIJ5 1/20 0.55
TSHR P16473 3/20 0.43
ALDH1A1 P00352 3/20 0.43
MAPK1 P28482 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
TGM2 P21980 5/20 0.35
TAS1R3 Q7RTX0 2/20 0.34
TAS1R1 Q7RTX1 2/20 0.34
GAA P10253 1/20 0.34
FAAH O00519 1/20 0.32
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
FFAR4 Q5NUL3 1/20 0.31
FFAR1 O14842 1/20 0.31
UBE2M P61081 1/20 0.30
DCUN1D1 Q96GG9 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
SCHEMBL7751004 0.87 ZDHHC20 (0.52) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL6021854 0.83 ZDHHC20 (0.47) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL28948518 0.81 TSHR (0.46) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL5058978 0.79 TDP1 (0.55) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL10613517 0.79 ZDHHC20 (0.51) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL151622 0.79 ZDHHC20 (0.50) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL20262206 0.78 TSHR (0.52) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL141762 0.78
SCHEMBL10661514 0.77 ZDHHC20 (0.53) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL8685401 0.76 PAOX (0.45) TSHRALDH1A1MAPK1TDP1FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107643558-B Optical film with adhesive layer laminated with separator 住友化学株式会社 2022-02-08 CN disclosed