SCHEMBL25874998

SCHEMBL25874998

C=CC(=O)Oc1ccc(-c2ccc3c(oc4cc(OC(=O)C=C)ccc43)c2C)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.40
KDM4E B2RXH2 12/20 0.40
GLA P06280 6/20 0.40
GAA P10253 5/20 0.40
POLB P06746 2/20 0.39
KMT2A Q03164 8/20 0.38
MAPT P10636 6/20 0.38
NPSR1 Q6W5P4 2/20 0.38
PPARG P37231 1/20 0.38
NCOA2 Q15596 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
THRB P10828 1/20 0.38
HPGD P15428 4/20 0.38
HSD17B10 Q99714 3/20 0.38
MAPK1 P28482 3/20 0.38
CASP1 P29466 2/20 0.38
CASP7 P55210 2/20 0.38
CA9 Q16790 1/20 0.38
USP2 O75604 1/20 0.38
HTT P42858 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
SCHEMBL25875101 0.87 HPGD (0.40) ALDH1A1KDM4EKMT2AMAPTNPSR1
SCHEMBL25875096 0.86 THRB (0.42) ALDH1A1KDM4EGLAGAAPOLB
SCHEMBL25875664 0.85 KMT2A (0.41) ALDH1A1KDM4EGLAGAAPOLB
SCHEMBL25873720 0.85 KDM4E (0.44) ALDH1A1KDM4EGLAGAAPOLB
SCHEMBL25875003 0.84 KDM4E (0.41) ALDH1A1KDM4EGLAGAAPOLB
SCHEMBL25875111 0.84 CYP2C9 (0.36) ALDH1A1KDM4EGLAGAAKMT2A
SCHEMBL25875457 0.83 KMT2A (0.38) ALDH1A1KDM4EGLAGAAPOLB
SCHEMBL25875215 0.82 KMT2A (0.34) ALDH1A1KDM4EKMT2AMAPTNPSR1
SCHEMBL25875300 0.81 KMT2A (0.35) ALDH1A1KDM4EGLAGAAPOLB
SCHEMBL25875988 0.81 ALDH1A1 (0.39) ALDH1A1KDM4EGAAPOLBKMT2A

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-2023134595-A1 POLYMERIZABLE COMPOUND, COMPOSITION, AND LIQUID CRYSTAL DISPLAY DEVICE 烟台显华科技集团股份有限公司 2023-07-20 WO disclosed
WO-2023134594-A1 NEGATIVE DIELECTRIC ANISOTROPIC LIQUID CRYSTAL COMPOSITION, OPTICAL ANISOTROPIER, AND LIQUID CRYSTAL DISPLAY COMPONENT 烟台显华科技集团股份有限公司 2023-07-20 WO disclosed