SCHEMBL31520107

SCHEMBL31520107

Nc1ccccc1C(=O)CC(NC(=O)CCCC(=O)O)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MME P08473 3/20 0.43
ACE P12821 3/20 0.43
C3AR1 Q16581 1/20 0.40
GNPAT O15228 1/20 0.39
ITGB3 P05106 1/20 0.38
ITGA2B P08514 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
HDAC3 O15379 2/20 0.38
HDAC4 P56524 2/20 0.38
HDAC1 Q13547 2/20 0.38
HDAC7 Q8WUI4 2/20 0.38
HDAC2 Q92769 2/20 0.38
HDAC10 Q969S8 2/20 0.38
HDAC11 Q96DB2 2/20 0.38
HDAC8 Q9BY41 2/20 0.38
HDAC6 Q9UBN7 2/20 0.38
HDAC9 Q9UKV0 2/20 0.38
HDAC5 Q9UQL6 2/20 0.38

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
SCHEMBL27373089 1.00 MME (0.43) MMEACEC3AR1GNPATITGB3
SCHEMBL27372873 0.92 GNPAT (0.43) MMEACEGNPATKDM4EALDH1A1
SCHEMBL8244848 0.86 FAAH (0.52) ITGB3ITGA2BKDM4EALDH1A1
SCHEMBL6846486 0.86 FAAH (0.52) ITGB3ITGA2BKDM4EALDH1A1
SCHEMBL30852301 0.81 MME (0.40) MMEACEC3AR1KDM4EALDH1A1
SCHEMBL27373092 0.81 MME (0.40) MMEACEC3AR1KDM4EALDH1A1
SCHEMBL14645210 0.80 ALDH1A1 (0.46) GNPATKDM4EALDH1A1
SCHEMBL3156486 0.80 ALDH1A1 (0.46) GNPATKDM4EALDH1A1
SCHEMBL31520049 0.80 ALDH1A1 (0.46) GNPATKDM4EALDH1A1
SCHEMBL30852311 0.79 HDAC3 (0.53) KDM4EALDH1A1HDAC3HDAC4HDAC1

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-120019060-A Compounds and their use for filtering ultraviolet and/or high-energy visible light 索利奥美公司 2025-05-16 CN disclosed