SCHEMBL31085367

SCHEMBL31085367

COc1cccc(OC)c1-c1cc(O)ccc1O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.57
EGFR P00533 1/20 0.51
PIM1 P11309 1/20 0.51
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
TP53 P04637 2/20 0.48
ALDH1A1 P00352 2/20 0.48
MAPT P10636 2/20 0.48
HPGD P15428 2/20 0.48
KDM4E B2RXH2 1/20 0.48
LMNA P02545 1/20 0.48
CYP3A4 P08684 1/20 0.48
ALOX15 P16050 1/20 0.48
ALOX12 P18054 1/20 0.48
MAPK1 P28482 1/20 0.48
HSD17B10 Q99714 1/20 0.48
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
TSHR P16473 1/20 0.45
CHEK1 O14757 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
SCHEMBL6574045 0.82 EGFR (0.49) MAOBEGFRPIM1KMT2AMEN1
SCHEMBL11776866 0.81 MAOB (0.57) MAOBKMT2AMEN1TP53ALDH1A1
SCHEMBL27638531 0.80 HIF1A (0.46) MAOBEGFRPIM1KMT2AMEN1
SCHEMBL28986013 0.79 MEN1 (0.62) EGFRPIM1KMT2AMEN1TP53
SCHEMBL10581373 0.76 ALDH1A1 (0.44) MAOBKMT2AMEN1TP53ALDH1A1
SCHEMBL6573444 0.75 PDE10A (0.50) MAOBEGFRPIM1KMT2AMEN1
SCHEMBL28305291 0.75 GAA (0.51) ALDH1A1MAPTHPGDWEE1NPC1
SCHEMBL28754763 0.74 MAOB (0.44) MAOBKMT2AMEN1ALDH1A1MAPT
SCHEMBL62784 0.73 MAOB (1.00) MAOBKMT2AMEN1TP53ALDH1A1
SCHEMBL29373807 0.73 MAOB (1.00) MAOBKMT2AMEN1TP53ALDH1A1

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-115926027-B Supported catalyst and preparation method thereof, and preparation method of polyolefin composite material 中国科学技术大学 2024-08-23 CN disclosed