SCHEMBL23005779

SCHEMBL23005779

CC(c1ccc(C(=O)O)c(N)c1)c1ccc(C(=O)O)c(N)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.51
TDP1 Q9NUW8 7/20 0.51
CYP3A4 P08684 2/20 0.51
ALOX15 P16050 1/20 0.51
KDM4E B2RXH2 9/20 0.49
HSD17B10 Q99714 4/20 0.49
HPGD P15428 3/20 0.49
PPM1B O75688 1/20 0.46
KMT2A Q03164 7/20 0.46
MEN1 O00255 6/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
GRM8 O00222 1/20 0.46
GRM6 O15303 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
DRD3 P35462 1/20 0.46
GRM4 Q14833 1/20 0.46
IDO1 P14902 1/20 0.44

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
SCHEMBL1454771 0.89 ALDH1A1 (0.55) ALDH1A1TDP1CYP3A4ALOX15KDM4E
SCHEMBL27553352 0.85 ALDH1A1 (0.50) ALDH1A1TDP1CYP3A4ALOX15KDM4E
SCHEMBL9860148 0.85 KDM4E (0.57) ALDH1A1TDP1CYP3A4ALOX15KDM4E
SCHEMBL20793894 0.82 ALDH1A1 (0.50) ALDH1A1TDP1CYP3A4ALOX15KDM4E
SCHEMBL3466210 0.82 TDP1 (0.45) ALDH1A1TDP1CYP3A4ALOX15KDM4E
SCHEMBL22733 0.82 HSD17B10 (0.60) ALDH1A1TDP1ALOX15KDM4EHSD17B10
SCHEMBL29401129 0.82 HSD17B10 (0.60) ALDH1A1TDP1ALOX15KDM4EHSD17B10
SCHEMBL22471781 0.81 ALDH1A1 (0.46) ALDH1A1TDP1CYP3A4ALOX15KDM4E
SCHEMBL28271886 0.80 ALDH1A1 (0.45) ALDH1A1TDP1CYP3A4ALOX15KDM4E
SCHEMBL2008242 0.80 ALDH1A1 (0.55) ALDH1A1TDP1CYP3A4ALOX15KDM4E

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
WO-2021029243-A1 COLORED RESIN COMPOSITION, CURED PRODUCT AND LAMINATE 太陽ホールディングス株式会社 2021-02-18 WO disclosed
WO-2021028960-A1 COLORED RESIN COMPOSITION, CURED PRODUCT, AND LAMINATE 太陽ホールディングス株式会社 2021-02-18 WO disclosed