SCHEMBL28539627

SCHEMBL28539627

O=C(O)c1cccc2c3ccccc3c3cccc(C(=O)O)c3c12

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A1 P22736 1/20 0.61
NR4A2 P43354 1/20 0.61
NR4A3 Q92570 1/20 0.61
PARP1 P09874 1/20 0.59
ALDH1A1 P00352 4/20 0.59
ALOX15 P16050 1/20 0.59
HSD17B10 Q99714 1/20 0.54
CDC25B P30305 2/20 0.53
PRNP P04156 1/20 0.53
CYP1A2 P05177 1/20 0.52
KDM4E B2RXH2 1/20 0.50
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
HMGB1 P09429 1/20 0.50
HPGD P15428 1/20 0.50
CA4 P22748 1/20 0.50
CA6 P23280 1/20 0.50
CA7 P43166 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL2876805 0.95 NR4A1 (0.61) NR4A1NR4A2NR4A3PARP1ALDH1A1
SCHEMBL19328252 0.89 NR4A1 (0.55) NR4A1NR4A2NR4A3PARP1ALDH1A1
SCHEMBL126721 0.84 NR4A1 (0.54) NR4A1NR4A2NR4A3PARP1ALDH1A1
SCHEMBL29549589 0.84 NR4A1 (0.54) NR4A1NR4A2NR4A3PARP1ALDH1A1
SCHEMBL12486214 0.82 NR4A1 (0.63) NR4A1NR4A2NR4A3PARP1ALDH1A1
SCHEMBL19178152 0.81 PTPN1 (0.57) NR4A1NR4A2NR4A3PARP1ALDH1A1
SCHEMBL3668375 0.81 GPR35 (0.51) NR4A1NR4A2NR4A3PARP1ALDH1A1
SCHEMBL2830679 0.81 NR4A1 (0.61) NR4A1NR4A2NR4A3PARP1ALDH1A1
SCHEMBL31401789 0.81 NR4A1 (0.61) NR4A1NR4A2NR4A3PARP1ALDH1A1
SCHEMBL29904701 0.81 NR4A1 (0.61) NR4A1NR4A2NR4A3PARP1ALDH1A1

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-112500569-B Polyimide precursor composition, polyimide film, laminated film, and display device 武汉柔显科技股份有限公司 2021-05-25 CN disclosed
CN-112500569-A Polyimide precursor composition, polyimide film, laminated film, and display device 武汉柔显科技股份有限公司 2021-03-16 CN disclosed