SCHEMBL28798490

SCHEMBL28798490

CC(C)(C)c1cc(CCC2CO2)cc(C(C)(C)C)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
ALDH1A1 P00352 10/20 0.46
GAA P10253 6/20 0.46
TSHR P16473 4/20 0.46
LMNA P02545 3/20 0.46
MAPK1 P28482 3/20 0.45
CYP1A2 P05177 2/20 0.45
CYP3A4 P08684 2/20 0.45
BLM P54132 2/20 0.45
ATM Q13315 2/20 0.45
HIF1A Q16665 2/20 0.45
NPSR1 Q6W5P4 2/20 0.45
GMNN O75496 1/20 0.45
GABBR2 O75899 1/20 0.45
TP53 P04637 1/20 0.45
CYP2C9 P11712 1/20 0.45
ALOX15 P16050 1/20 0.45
NFKB1 P19838 1/20 0.45
CYP2C19 P33261 1/20 0.45

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
SCHEMBL25024559 0.90 KMT2A (0.45) KMT2AMEN1ALDH1A1GAATSHR
SCHEMBL11259488 0.83 ALDH1A1 (0.49) KMT2AMEN1ALDH1A1GAATSHR
SCHEMBL19677860 0.81 ALDH1A1 (0.51) KMT2AMEN1ALDH1A1GAATSHR
SCHEMBL19677863 0.78 ALDH1A1 (0.49) KMT2AMEN1ALDH1A1GAATSHR
SCHEMBL19677849 0.78 ALDH1A1 (0.49) KMT2AMEN1ALDH1A1GAATSHR
SCHEMBL284696 0.78 ALDH1A1 (0.63) KMT2AMEN1ALDH1A1GAATSHR
SCHEMBL19312981 0.77 KMT2A (0.50) KMT2AMEN1ALDH1A1GAATSHR
SCHEMBL23389360 0.76 ALDH1A1 (0.42) KMT2AMEN1ALDH1A1GAATSHR
SCHEMBL9735957 0.76 KDM4E (0.42) KMT2AMEN1ALDH1A1GAAKDM4E
SCHEMBL3676323 0.76 KMT2A (0.50) KMT2AMEN1GAAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114806011-B Propylene polymer composition and preparation method thereof 威高集团有限公司 2023-09-22 CN claimed
CN-114806011-A Propylene polymer composition and preparation method thereof 威高集团有限公司 2022-07-29 CN claimed
CN-114806011-B Propylene polymer composition and preparation method thereof 威高集团有限公司 2023-09-22 CN disclosed
CN-114806011-A Propylene polymer composition and preparation method thereof 威高集团有限公司 2022-07-29 CN disclosed