SCHEMBL8033873

SCHEMBL8033873

CC(C)(C)OC(=O)NCC(=O)Nc1ccccc1OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.59
KMT2A Q03164 1/20 0.57
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
HDAC1 Q13547 1/20 0.46
PPIA P62937 2/20 0.46
SYK P43405 1/20 0.46
POLB P06746 1/20 0.45
GAA P10253 1/20 0.45
CYP2C19 P33261 2/20 0.44
NPFFR1 Q9GZQ6 1/20 0.44
NPFFR2 Q9Y5X5 1/20 0.44
HTT P42858 2/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
MAPT P10636 1/20 0.43
CYP2C9 P11712 1/20 0.43
MAPK1 P28482 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL7342794 0.87 BRD4 (0.68) BRD4KMT2ATDP1L3MBTL1HDAC1
SCHEMBL7043590 0.81 LTA4H (0.62) KMT2AALDH1A1SMN1; SMN2
SCHEMBL12322221 0.81 SGMS2 (0.53) BRD4KMT2AL3MBTL1SYKGAA
SCHEMBL8577017 0.81 HTR1A (0.46) SYKNPFFR1NPFFR2CYP2C9SIGMAR1
SCHEMBL8030272 0.80 KMT2A (0.48) KMT2ATDP1L3MBTL1POLBGAA
SCHEMBL6432668 0.80 HDAC1 (0.46) KMT2AHDAC1POLBSMN1; SMN2
SCHEMBL10845357 0.78 MAPT (0.47) KMT2ATDP1HDAC1POLBGAA
SCHEMBL29193980 0.78 LMNA (0.45) KMT2AHDAC1POLBNPFFR1NPFFR2
SCHEMBL294159 0.78 BRD4 (0.54) BRD4KMT2ATDP1L3MBTL1HDAC1
SCHEMBL30705048 0.78 BRD4 (0.54) BRD4KMT2ATDP1L3MBTL1HDAC1

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 3 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
US-5919824-A Aminophenol derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1999-07-06 US disclosed
CN-1178523-A Aminophenol derivatives DIICHI PHARMACEUTICAL CO LTD (JP) 1998-04-08 CN disclosed