SCHEMBL29637877

SCHEMBL29637877

CCc1c(C(=O)O)c(C(=O)O)c(C(=O)NO)c(C(=O)NO)c1-c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 2/20 0.38
FABP4 P15090 2/20 0.38
FABP5 Q01469 1/20 0.38
HDAC8 Q9BY41 3/20 0.37
LMNA P02545 4/20 0.37
DHODH Q02127 1/20 0.37
HDAC1 Q13547 3/20 0.37
HDAC7 Q8WUI4 3/20 0.37
HDAC3 O15379 2/20 0.37
HDAC2 Q92769 2/20 0.37
HDAC6 Q9UBN7 2/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
IDO1 P14902 1/20 0.37
ALOX15 P16050 1/20 0.37
CA9 Q16790 1/20 0.37
HSD17B10 Q99714 1/20 0.37
NCOR2 Q9Y618 1/20 0.37
ADORA3 P0DMS8 1/20 0.36
TACR3 P29371 3/20 0.36

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
SCHEMBL7664295 0.73 LMNA (0.45) FABP3FABP4FABP5LMNADHODH
SCHEMBL5587371 0.72 ESR1 (0.42) FABP3FABP4FABP5LMNADHODH
SCHEMBL28392917 0.71 ALDH1A1 (0.44) FABP3FABP4FABP5LMNADHODH
SCHEMBL7766728 0.71 HDAC8 (0.31) HDAC8
SCHEMBL27835468 0.71 LMNA (0.45) FABP3FABP4FABP5LMNAKDM4E
SCHEMBL28068348 0.70 KDM4E (0.43) FABP3FABP4FABP5LMNADHODH
SCHEMBL8566465 0.69 FOLH1 (0.40) HSD17B10ALDH1A1MAPTRAB9A
SCHEMBL29581055 0.69 ALDH1A1 (0.42) FABP3FABP4FABP5LMNADHODH
SCHEMBL2238425 0.69 HDAC8 (0.48) HDAC8HDAC1HDAC7HDAC3HDAC2
SCHEMBL31402496 0.68 MAPT (0.51) LMNAIDO1HSD17B10KDM4EALDH1A1

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-110591063-B Modified polyethylene naphthalate containing imide structure and preparation method thereof 沈阳建筑大学 2022-06-07 CN disclosed