SCHEMBL25875989

SCHEMBL25875989

C=C(C)C(=O)Oc1ccc(-c2ccc3c(oc4c(OC)c(OC(=O)C(=C)C)ccc43)c2C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.41
MEN1 O00255 3/20 0.41
ALDH1A1 P00352 7/20 0.39
KDM4E B2RXH2 6/20 0.39
ADORA3 P0DMS8 1/20 0.39
HTT P42858 2/20 0.39
GAA P10253 1/20 0.39
POLB P06746 3/20 0.38
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
ELANE P08246 1/20 0.36
HPGD P15428 3/20 0.35
HSD17B10 Q99714 3/20 0.35
MAPK1 P28482 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
BACE1 P56817 1/20 0.34
ATM Q13315 1/20 0.34
TUBB4A P04350 2/20 0.34
TUBB P07437 2/20 0.34
TUBA3C P0DPH7 2/20 0.34

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
SCHEMBL25876144 0.92 ADORA3 (0.41) KMT2AMEN1ALDH1A1KDM4EADORA3
SCHEMBL25875672 0.91 KMT2A (0.43) KMT2AMEN1ALDH1A1KDM4EADORA3
SCHEMBL25875667 0.90 KMT2A (0.42) KMT2AMEN1ALDH1A1KDM4EADORA3
SCHEMBL25875982 0.88 MAOA (0.38) KMT2AMEN1ALDH1A1KDM4EADORA3
SCHEMBL25876707 0.88 ADORA3 (0.36) KMT2AMEN1ALDH1A1KDM4EADORA3
SCHEMBL25875301 0.86 KMT2A (0.37) KMT2AMEN1ALDH1A1KDM4EADORA3
SCHEMBL25876151 0.85 ADORA3 (0.36) KMT2AMEN1ALDH1A1KDM4EADORA3
SCHEMBL25874215 0.85 KDM4E (0.47) KMT2AMEN1ALDH1A1KDM4EHTT
SCHEMBL25875988 0.85 ALDH1A1 (0.39) KMT2AMEN1ALDH1A1KDM4EADORA3
SCHEMBL25874472 0.83 MAOA (0.47) KMT2AMEN1ALDH1A1KDM4EHTT

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-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
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