SCHEMBL8033749

SCHEMBL8033749

Cc1cc(C)cc(N(C)C(=O)COc2cccc(N(CC(=O)N(C)c3ccccc3)C(=O)CN)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 2/20 0.43
GRM5 P41594 1/20 0.42
KDM4E B2RXH2 3/20 0.41
KMT2A Q03164 7/20 0.41
MEN1 O00255 6/20 0.41
MAPK1 P28482 1/20 0.39
NTSR1 P30989 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
NOD2 Q9HC29 1/20 0.39
POLQ O75417 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
ALDH1A1 P00352 1/20 0.38
THRB P10828 1/20 0.38

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
SCHEMBL8030265 0.94 KMT2A (0.43) MLYCDKDM4EKMT2AMEN1MAPK1
SCHEMBL8036245 0.92 POLQ (0.47) MLYCDKDM4EKMT2AMEN1POLQ
SCHEMBL8030044 0.89 MLYCD (0.43) MLYCDGRM5KDM4EKMT2AMEN1
SCHEMBL8031968 0.88 KMT2A (0.43) MLYCDKDM4EKMT2AMEN1MAPK1
SCHEMBL27487708 0.87 MLYCD (0.43) MLYCDKDM4EKMT2AMEN1MAPK1
SCHEMBL8031976 0.87 ALDH1A1 (0.47) MLYCDGRM5KDM4EKMT2AMEN1
SCHEMBL8034098 0.86 KMT2A (0.46) MLYCDKDM4EKMT2AMEN1MAPK1
SCHEMBL9134211 0.86 TSHR (0.43) MLYCDKDM4EMAPK1SMN1; SMN2ALDH1A1
SCHEMBL8034135 0.84 MLYCD (0.40) MLYCDGRM5KDM4EKMT2AMEN1
SCHEMBL8030133 0.84 ALDH1A1 (0.45) MLYCDKDM4EKMT2AMEN1MAPK1

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 2 patents. 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
CN-1178523-A Aminophenol derivatives DIICHI PHARMACEUTICAL CO LTD (JP) 1998-04-08 CN disclosed