SCHEMBL26044895

SCHEMBL26044895

CCCCCOc1ccc(C(=O)C2CCC(C3CCC(CCC)CC3)CC2)c(F)c1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 4/20 0.38
CNR2 P34972 4/20 0.38
CYP2C9 P11712 1/20 0.38
THRB P10828 3/20 0.36
CCNE2 O96020 1/20 0.35
CCNE1 P24864 1/20 0.35
CDK2 P24941 1/20 0.35
MEN1 O00255 1/20 0.35
NR1I2 O75469 1/20 0.35
LMNA P02545 1/20 0.35
CHRM2 P08172 1/20 0.35
CYP3A4 P08684 1/20 0.35
ADRA2A P08913 1/20 0.35
MAPT P10636 1/20 0.35
OPRK1 P41145 1/20 0.35
HTR2B P41595 1/20 0.35
SLC6A3 Q01959 1/20 0.35
KMT2A Q03164 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
THRA P10827 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
SCHEMBL26044894 0.97 CCNE2 (0.38) CNR1CNR2CYP2C9CCNE2CCNE1
SCHEMBL26044867 0.97 CNR1 (0.40) CNR1CNR2CYP2C9THRBCCNE2
SCHEMBL26044900 0.96 CNR1 (0.38) CNR1CNR2CYP2C9THRBCCNE2
SCHEMBL26044907 0.96 CNR1 (0.38) CNR1CNR2CYP2C9THRBCCNE2
SCHEMBL26044906 0.94 CCNE2 (0.38) CNR1CNR2CYP2C9THRBCCNE2
SCHEMBL26044893 0.93 CNR1 (0.36) CNR1CNR2CYP2C9CCNE2CCNE1
SCHEMBL26044865 0.93 CCNE2 (0.40) CNR1CNR2CYP2C9CCNE2CCNE1
SCHEMBL26044904 0.93 PKM (0.35) CNR1CNR2CYP2C9THRBCCNE2
SCHEMBL26044890 0.92 CNR1 (0.38) CNR1CNR2CYP2C9THRBCCNE2
SCHEMBL26044875 0.92 CNR1 (0.40) CNR1CNR2CYP2C9THRBCCNE2

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
US-20230265345-A1 LIQUID CRYSTAL COMPOSITION CONTAINING POLYMERIZABLE COMPOUND AND APPLICATION OF LIQUID CRYSTAL COMPOSITION BEIJING BAYI SPACE LCD TECHNOLOGY CO., LTD. (CN) 2023-08-24 US disclosed