SCHEMBL25906180

SCHEMBL25906180

C=C(C)COc1ccc2c(oc3c(C)c(OC(=O)C(=C)C)ccc32)c1C

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.60
ALDH1A1 P00352 10/20 0.60
HPGD P15428 8/20 0.60
MAPT P10636 2/20 0.60
HSD17B10 Q99714 9/20 0.57
SMN1; SMN2 Q16637 5/20 0.57
TSHR P16473 5/20 0.57
NPC1 O15118 4/20 0.57
LMNA P02545 3/20 0.57
RAB9A P51151 3/20 0.57
HTT P42858 3/20 0.57
NPSR1 Q6W5P4 2/20 0.53
POLB P06746 1/20 0.53
MAOA P21397 6/20 0.52
MAOB P27338 6/20 0.52
MAPK1 P28482 1/20 0.46
TP53 P04637 1/20 0.45
FHIT P49789 2/20 0.44
KMT2A Q03164 1/20 0.44
ATM Q13315 1/20 0.43

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
SCHEMBL25874210 0.89 GBA1 (0.49) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL25906136 0.83 HPGD (0.49) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL25873934 0.81 GBA1 (0.43) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL25874215 0.80 KDM4E (0.47) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL25874323 0.78 GBA1 (0.41) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL25874213 0.77 MAOA (0.38) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL25875667 0.76 KMT2A (0.42) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL25874329 0.76 GBA1 (0.39) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL25873722 0.75 KDM4E (0.47) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL7917900 0.75 KDM4E (0.68) KDM4EALDH1A1HPGDMAPTHSD17B10

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
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