SCHEMBL8030265

SCHEMBL8030265

Cc1cccc(N(C)C(=O)COc2cccc(N(CC(=O)N(C)c3ccccc3)C(=O)CN)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
MLYCD O95822 2/20 0.43
KDM4E B2RXH2 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
TP53 P04637 1/20 0.41
HTT P42858 2/20 0.41
NPC1 O15118 1/20 0.41
JAK2 O60674 1/20 0.41
ALDH1A1 P00352 1/20 0.41
RAB9A P51151 1/20 0.41
PAX8 Q06710 1/20 0.41
POLQ O75417 1/20 0.41
LTB4R2 Q9NPC1 1/20 0.40
HSD17B1 P14061 1/20 0.40
HSD17B2 P37059 1/20 0.40
RECQL P46063 1/20 0.40
MAPK1 P28482 1/20 0.39
NTSR1 P30989 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL8033749 0.94 MLYCD (0.43) KMT2AMEN1MLYCDKDM4ETDP1
SCHEMBL8031976 0.89 ALDH1A1 (0.47) KMT2AMEN1MLYCDKDM4ETP53
SCHEMBL27487708 0.89 MLYCD (0.43) KMT2AMEN1MLYCDKDM4EHTT
SCHEMBL8036245 0.88 POLQ (0.47) KMT2AMEN1MLYCDKDM4ETDP1
SCHEMBL8031968 0.88 KMT2A (0.43) KMT2AMEN1MLYCDKDM4ETDP1
SCHEMBL8030044 0.87 MLYCD (0.43) KMT2AMEN1MLYCDKDM4EHTT
SCHEMBL8034030 0.86 KMT2A (0.45) KMT2AMEN1MLYCDKDM4ETDP1
SCHEMBL8034098 0.86 KMT2A (0.46) KMT2AMEN1MLYCDKDM4ETDP1
SCHEMBL9134211 0.86 TSHR (0.43) MLYCDKDM4ETP53NPC1ALDH1A1
SCHEMBL8036352 0.84 KMT2A (0.43) KMT2AMEN1HTTNPC1JAK2

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