SCHEMBL7930156

SCHEMBL7930156

CCOc1ccc(C(=O)NCC(O)c2cc(OC)c(OC)c(OC)c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.57
NPSR1 Q6W5P4 1/20 0.57
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54
ALDH1A1 P00352 5/20 0.52
MAPT P10636 3/20 0.52
KDM4E B2RXH2 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
LMNA P02545 2/20 0.52
TSHR P16473 1/20 0.51
MAPK1 P28482 1/20 0.51
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
POLB P06746 2/20 0.49
HDAC1 Q13547 1/20 0.48
HDAC8 Q9BY41 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
HTT P42858 1/20 0.47
BRD4 O60885 1/20 0.47
CYP1A2 P05177 1/20 0.47

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
SCHEMBL7930108 0.83 KMT2A (0.57) KMT2AMEN1LMNAMAPK1NPC1
SCHEMBL7928025 0.76 SMPD1 (0.56) HPGDNPSR1KMT2AMEN1MAPT
SCHEMBL7927749 0.74 ALDH1A1 (0.57) HPGDNPSR1KMT2AMEN1ALDH1A1
SCHEMBL7920931 0.73 TP53 (0.42) MAPTHDAC8HDAC6
SCHEMBL7929603 0.73 SMYD3 (0.45) MAPTSMN1; SMN2LMNAPOLBHDAC1
SCHEMBL4628473 0.72 MAPT (0.56) HPGDKMT2AMEN1ALDH1A1MAPT
SCHEMBL11818791 0.71 KMT2A (0.52) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL4628483 0.71 SCN2A (0.73) HPGDALDH1A1MAPTKDM4ESMN1; SMN2
SCHEMBL29236663 0.71 MAPT (0.60) HPGDKMT2AMEN1ALDH1A1MAPT
SCHEMBL2920246 0.71 MAPK1 (0.65) KMT2AMEN1ALDH1A1KDM4ESMN1; SMN2

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
US-6228868-B1 ANTICARCINOGENIC AND ANTITUMOR AGENTS ABBOTT LABORATORIES 2001-05-08 US disclosed