SCHEMBL25501673

SCHEMBL25501673

CC1(C)CCCC(C)(C)N1OC(COC(=O)c1cc(C(=O)OCC(ON2C(C)(C)CCCC2(C)C)c2ccccc2)cc(C(=O)OCC(ON2C(C)(C)CCCC2(C)C)c2ccccc2)c1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
ADRB2 P07550 3/20 0.37
ADRB1 P08588 3/20 0.37
ADRB3 P13945 3/20 0.37
CHRM2 P08172 3/20 0.36
CHRM1 P11229 3/20 0.36
CHRM3 P20309 3/20 0.36
CHRM4 P08173 2/20 0.36
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
LMNA P02545 3/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
HPGD P15428 1/20 0.34
MAPK1 P28482 1/20 0.34
CYP2C19 P33261 1/20 0.34
PABPC1 P11940 1/20 0.34
APOBEC3A P31941 1/20 0.34
APOBEC3G Q9HC16 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
SCHEMBL410781 0.94 ALDH1A1 (0.44) ALDH1A1ADRB2ADRB1ADRB3CHRM2
SCHEMBL4886714 0.86 PABPC1 (0.41) ALDH1A1CHRM2CHRM1CHRM3CHRM4
SCHEMBL12794193 0.85 ALDH1A1 (0.39) ALDH1A1ADRB2ADRB1ADRB3KMT2A
SCHEMBL3556437 0.84 CYCS (0.42)
SCHEMBL13846311 0.83 LMNA (0.34) ALDH1A1CHRM2CHRM1CHRM3CHRM4
SCHEMBL3558888 0.83 CYCS (0.42)
SCHEMBL1005104 0.82 PABPC1 (0.39) ALDH1A1CHRM2CHRM1CHRM3CHRM4
SCHEMBL29786589 0.82 THRB (0.36) ALDH1A1CHRM2CHRM1CHRM3CHRM4
SCHEMBL5074915 0.81 CYP1A2 (0.48) ALDH1A1KMT2AMEN1LMNASMN1; SMN2
SCHEMBL19834253 0.81 LMNA (0.33) ALDH1A1CHRM2CHRM1CHRM3CHRM4

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230265346-A1 LIQUID CRYSTAL COMPOSITION, OPTICALLY ANISOTROPIC LAYER, LAMINATE, AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2023-08-24 US disclosed
US-20230159827-A1 LIQUID CRYSTAL COMPOSITION, FLUORINE-CONTAINING POLYMER, OPTICALLY ANISOTROPIC LAYER, LAMINATE, AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2023-05-25 US disclosed
US-20230159827-A1 LIQUID CRYSTAL COMPOSITION, FLUORINE-CONTAINING POLYMER, OPTICALLY ANISOTROPIC LAYER, LAMINATE, AND IMAGE DISPLAY DEVICE FUJIFILM CORPORATION (JP) 2023-05-25 US disclosed