SCHEMBL28020117

SCHEMBL28020117

CCOC(=O)c1c(C)c(C)c(C)c(C)c1OC(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.49
USP2 O75604 1/20 0.46
HPGD P15428 4/20 0.42
ALDH1A1 P00352 7/20 0.42
LMNA P02545 2/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
MAPT P10636 2/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
GAA P10253 1/20 0.42
NR1H2 P55055 1/20 0.41
NR1H3 Q13133 1/20 0.41
MAPK1 P28482 3/20 0.40
POLB P06746 3/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL28820152 0.79 KMT2A (0.42) KMT2AUSP2HPGDALDH1A1LMNA
SCHEMBL17965819 0.78 KMT2A (0.59) KMT2AUSP2HPGDALDH1A1SMN1; SMN2
SCHEMBL10444735 0.76 ALDH1A1 (0.58) KMT2AUSP2HPGDALDH1A1SMN1; SMN2
SCHEMBL2924743 0.75 CA12 (0.50) KMT2AHPGDALDH1A1LMNASMN1; SMN2
SCHEMBL6738868 0.75 KDM4E (0.44) KMT2AUSP2HPGDALDH1A1LMNA
SCHEMBL9826319 0.73 KDM4E (0.40) HPGDALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL28020090 0.72 CA12 (0.43) KMT2AUSP2HPGDALDH1A1LMNA
SCHEMBL498642 0.71 CYP3A4 (0.47) KMT2AUSP2HPGDALDH1A1LMNA
SCHEMBL31522038 0.71 MAPT (0.46) KMT2AUSP2ALDH1A1SMN1; SMN2MAPT
SCHEMBL9825653 0.71 KMT2A (0.42) KMT2AUSP2HPGDALDH1A1LMNA

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-104829756-A Solid catalyst component for olefin polymerization, and preparation method and application thereof CHINESE ACAD INST CHEMISTRY 2015-08-12 CN disclosed