SCHEMBL30023765

SCHEMBL30023765

Nc1c(C(=O)O)cc(O)c(O)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.47
ALDH1A1 P00352 6/20 0.47
MAPT P10636 3/20 0.47
CASP7 P55210 3/20 0.47
HSD17B10 Q99714 3/20 0.47
TDP1 Q9NUW8 3/20 0.47
HPGD P15428 3/20 0.47
KMT2A Q03164 3/20 0.47
CYP3A4 P08684 2/20 0.47
THRB P10828 2/20 0.47
MEN1 O00255 2/20 0.47
KDR P35968 2/20 0.47
CASP1 P29466 2/20 0.47
PTGS2 P35354 2/20 0.47
PTPN1 P18031 2/20 0.47
TNF P01375 1/20 0.47
HSPD1 P10809 1/20 0.47
CYP2C9 P11712 1/20 0.47
ALOX15 P16050 1/20 0.47
CYP2C19 P33261 1/20 0.47

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
SCHEMBL13064872 1.00 KDM4E (0.47) KDM4EALDH1A1MAPTCASP7HSD17B10
SCHEMBL27121360 0.83 KDM4E (0.44) KDM4EALDH1A1MAPTCASP7HSD17B10
SCHEMBL28811573 0.78 AKR1C2 (0.53) KDM4EALDH1A1MAPTCASP7HSD17B10
SCHEMBL3517151 0.78 SELL (0.58) KDM4EALDH1A1MAPTCASP7HSD17B10
SCHEMBL27829092 0.77 KDM4E (0.42) KDM4EALDH1A1MAPTCASP7HSD17B10
SCHEMBL13064873 0.77 TPMT (0.46) KDM4EALDH1A1MAPTCASP7HSD17B10
SCHEMBL27847670 0.77 KDM4E (0.42) KDM4EALDH1A1MAPTCASP7HSD17B10
SCHEMBL674849 0.76 SELL (0.50) KDM4EALDH1A1MAPTHSD17B10TDP1
SCHEMBL31674337 0.76 SELL (0.50) KDM4EALDH1A1MAPTHSD17B10TDP1
SCHEMBL29493314 0.76 SELL (0.50) KDM4EALDH1A1MAPTHSD17B10TDP1

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-112768571-B Manufacturing method of micro light-emitting diode structure 广东晶相光电科技有限公司 2022-11-25 CN disclosed