SCHEMBL8033770

SCHEMBL8033770

COC(=O)Cc1cccc(NC(=O)NCC(=O)N(CC2CCCCC2)c2ccccc2OCC(=O)N(C)c2cc(F)cc(F)c2)c1

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CCR3 P51677 5/20 0.34
HTR2A P28223 3/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
EPHX1 P07099 2/20 0.33
EPHX2 P34913 1/20 0.33
HPGD P15428 1/20 0.32
ACKR3 P25106 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
HTT P42858 1/20 0.32
BDKRB2 P30411 1/20 0.32
MGLL Q99685 1/20 0.32

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
SCHEMBL8033886 0.99 KMT2A (0.35) MEN1KMT2ACCR3HTR2AGAA
SCHEMBL8033899 0.94 KMT2A (0.34) MEN1KMT2ACCR3HTR2ASMN1; SMN2
SCHEMBL8030316 0.94 MEN1 (0.35) MEN1KMT2ACCR3HTR2AGAA
SCHEMBL8034117 0.93 KMT2A (0.35) MEN1KMT2ACCR3HTR2AGAA
SCHEMBL8030426 0.93 KMT2A (0.36) MEN1KMT2ACCR3HTR2AGAA
SCHEMBL8031951 0.91 HTR2A (0.34) MEN1KMT2ACCR3HTR2ASMN1; SMN2
SCHEMBL8032029 0.90 BDKRB2 (0.36) MEN1KMT2ACCR3HTR2AGAA
SCHEMBL8030228 0.90 KMT2A (0.34) MEN1KMT2ACCR3HTR2ASMN1; SMN2
SCHEMBL8036229 0.90 EPHX2 (0.41) MEN1KMT2AGAASMN1; SMN2EPHX1
SCHEMBL8020602 0.89 KMT2A (0.42) MEN1KMT2ACCR3HTR2AGAA

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
EP-0985660-A1 AMINOPHENOL DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2000-03-15 EP disclosed