SCHEMBL28622308

SCHEMBL28622308

CCCCOC(C)OC(C)OC(C)OC(C)OC(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
TSHR P16473 6/20 0.46
PDCD1 Q15116 1/20 0.44
CD274 Q9NZQ7 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
CYP1A2 P05177 2/20 0.43
CYP2C19 P33261 2/20 0.43
ESR1 P03372 1/20 0.43
CYP2D6 P10635 1/20 0.43
MAPK1 P28482 1/20 0.43
NR1H2 P55055 1/20 0.43
RNASEL Q05823 1/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
ALDH1A1 P00352 1/20 0.43
HTT P42858 1/20 0.43
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42

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
SCHEMBL16278308 1.00 LMNA (0.46) LMNAMEN1KMT2ATSHRPDCD1
SCHEMBL17797881 0.99 LMNA (0.47) LMNAMEN1KMT2ATSHRPDCD1
SCHEMBL17798303 0.94 TSHR (0.50) LMNAKMT2ATSHRSMN1; SMN2CYP1A2
SCHEMBL28518170 0.94 TSHR (0.50) LMNAKMT2ATSHRSMN1; SMN2CYP1A2
SCHEMBL17797860 0.93 TSHR (0.51) LMNAKMT2ATSHRSMN1; SMN2CYP1A2
SCHEMBL17824379 0.92 TSHR (0.49) LMNATSHRSMN1; SMN2CYP1A2CYP2C19
SCHEMBL15093325 0.91 LMNA (0.51) LMNAMEN1KMT2ATSHRPDCD1
SCHEMBL17798278 0.90 TSHR (0.42) LMNATSHRSMN1; SMN2CYP1A2CYP2C19
SCHEMBL17798295 0.90 TSHR (0.50) LMNATSHRSMN1; SMN2CYP1A2CYP2C19
SCHEMBL809487 0.89 TSHR (0.43) LMNATSHRSMN1; SMN2CYP1A2CYP2C19

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
CN-109311281-B Interlayers comprising optical films having enhanced optical properties 首诺公司 2021-09-14 CN disclosed