SCHEMBL25875212

SCHEMBL25875212

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

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.38
KDM4E B2RXH2 8/20 0.38
GLA P06280 3/20 0.38
GAA P10253 3/20 0.38
CYP2C9 P11712 1/20 0.37
GAPDH P04406 1/20 0.36
ELANE P08246 1/20 0.36
HPGD P15428 4/20 0.35
LMNA P02545 2/20 0.35
KMT2A Q03164 5/20 0.34
MAPT P10636 4/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
PPARG P37231 1/20 0.34
NCOA2 Q15596 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
CA9 Q16790 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HTT P42858 1/20 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
SCHEMBL25875214 0.87 PPARA (0.33) ALDH1A1KDM4EGLAGAACYP2C9
SCHEMBL25876563 0.87 ELANE (0.37) CYP2C9GAPDHELANEKMT2APPARG
SCHEMBL25873793 0.87 CYP2C9 (0.42) ALDH1A1KDM4EGLAGAACYP2C9
SCHEMBL25875003 0.85 KDM4E (0.41) ALDH1A1KDM4EGLAGAACYP2C9
SCHEMBL25875216 0.85 GAPDH (0.35) ALDH1A1KDM4EGLAGAAGAPDH
SCHEMBL25876292 0.85 CYP2C9 (0.37) ALDH1A1KDM4EGLAGAACYP2C9
SCHEMBL25875111 0.85 CYP2C9 (0.36) ALDH1A1KDM4EGLAGAACYP2C9
SCHEMBL25875782 0.84 KMT2A (0.38) ALDH1A1KDM4EGLAGAAGAPDH
SCHEMBL25875382 0.84 ELANE (0.35) ELANEKMT2AATMMEN1
SCHEMBL25875104 0.83 ALDH1A1 (0.40) ALDH1A1KDM4EGLAGAAGAPDH

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