SCHEMBL30819481

SCHEMBL30819481

C=CC(=O)NCCCC(=C)C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.50
ZDHHC2 Q9UIJ5 1/20 0.50
TSHR P16473 3/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPK1 P28482 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
TGM2 P21980 6/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 2/20 0.34
FGFR4 P22455 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
BTK Q06187 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
SCHEMBL3404807 0.90 ZDHHC20 (0.45) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL22721386 0.89 TSHR (0.46) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL8403690 0.89 ZDHHC20 (0.60) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL28344839 0.84 ZDHHC20 (0.57) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL21408788 0.82 TSHR (0.48) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL28204287 0.80 ZDHHC20 (0.58) ZDHHC20ZDHHC2ALDH1A1TDP1MAPT
SCHEMBL20081677 0.79 ZDHHC20 (0.55) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL28390404 0.78 ZDHHC20 (0.44) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL11172218 0.78 ZDHHC20 (0.65) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL10735088 0.78 ZDHHC20 (0.65) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1

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
CN-117794635-A Improvements in or relating to organic compounds 奇华顿股份有限公司 2024-03-29 CN claimed
CN-117794635-A Improvements in or relating to organic compounds 奇华顿股份有限公司 2024-03-29 CN disclosed