SCHEMBL27554196

SCHEMBL27554196

Cc1cc(C)c(C(=O)C(C(=O)OC(C)(C)C)c2ccccc2)c(C)c1.O=P

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.38
MMP8 P22894 1/20 0.37
LMNA P02545 4/20 0.36
KMT2A Q03164 2/20 0.36
ATM Q13315 1/20 0.35
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
SLC6A3 Q01959 2/20 0.35
SRC P12931 1/20 0.35
GAA P10253 1/20 0.35
HTT P42858 1/20 0.35
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALDH1A1 P00352 1/20 0.34
KDM4E B2RXH2 1/20 0.34
AAK1 Q2M2I8 1/20 0.34
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34

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
SCHEMBL7189399 0.96 L3MBTL1 (0.38) L3MBTL1MMP8LMNAKMT2AATM
SCHEMBL27486004 0.90 L3MBTL1 (0.46) L3MBTL1MMP8LMNAKMT2AATM
SCHEMBL7181823 0.87 L3MBTL1 (0.37) L3MBTL1MMP8LMNAKMT2AATM
SCHEMBL7187383 0.85 L3MBTL1 (0.46) L3MBTL1MMP8LMNAKMT2AATM
SCHEMBL27499986 0.85 KMT2A (0.47) L3MBTL1MMP8LMNAKMT2ASLC6A2
SCHEMBL27485655 0.83 MMP8 (0.55) L3MBTL1MMP8KMT2AATMSLC6A2
SCHEMBL7183225 0.83 L3MBTL1 (0.36) L3MBTL1MMP8LMNAKMT2AATM
SCHEMBL14781389 0.82 SRC (0.47) L3MBTL1MMP8LMNAKMT2ASLC6A2
SCHEMBL27486287 0.82 L3MBTL1 (0.39) L3MBTL1MMP8LMNAKMT2ASLC6A2
SCHEMBL27484989 0.82 L3MBTL1 (0.41) L3MBTL1MMP8LMNAKMT2AGAA

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
CN-1200943-C Organometallic acyl-aryl phosphine CIBA SC HOLDING AG (CH) 2005-05-11 CN disclosed
CN-1308081-A Organometallic acyl-aryl phosphine CIBA SC HOLDING AG (CH) 2001-08-15 CN disclosed