SCHEMBL4166594

SCHEMBL4166594

Cc1cc(C(=O)NCC(=O)O)ccc1-c1cccc2c(CCCOc3cccc4ccccc34)c(C(=O)O)[nH]c12

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCD Q05655 4/20 0.77
CAMK2B Q13554 4/20 0.77
CAMK2G Q13555 4/20 0.77
AURKB Q96GD4 3/20 0.77
MCL1 Q07820 17/20 0.73
NEK4 P51957 3/20 0.58
CAMK2D Q13557 3/20 0.58
HIPK2 Q9H2X6 3/20 0.58
MAP3K20 Q9NYL2 3/20 0.58
MAP4K5 Q9Y4K4 3/20 0.58
MARK3 P27448 2/20 0.58
AXL P30530 2/20 0.58
MARK2 Q7KZI7 2/20 0.58
PIM3 Q86V86 2/20 0.58
MKNK2 Q9HBH9 2/20 0.58
MAP4K2 Q12851 2/20 0.58
CDC42BPA Q5VT25 2/20 0.58
TAOK1 Q7L7X3 2/20 0.58
HIPK4 Q8NE63 2/20 0.58
SRPK1 Q96SB4 2/20 0.58

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
SCHEMBL4164336 0.90 MCL1 (0.84) PRKCDCAMK2BCAMK2GAURKBMCL1
SCHEMBL4162305 0.89 PRKCD (0.78) PRKCDCAMK2BCAMK2GAURKBMCL1
SCHEMBL4154215 0.87 MCL1 (0.71) PRKCDCAMK2BCAMK2GAURKBMCL1
SCHEMBL4154220 0.87 MCL1 (0.71) PRKCDCAMK2BCAMK2GAURKBMCL1
SCHEMBL4159748 0.87 PRKCD (1.00) PRKCDCAMK2BCAMK2GAURKBMCL1
SCHEMBL4173562 0.86 PRKCD (0.69) PRKCDCAMK2BCAMK2GAURKBMCL1
SCHEMBL4162793 0.86 PRKCD (0.69) PRKCDCAMK2BCAMK2GAURKBMCL1
SCHEMBL4162789 0.86 PRKCD (0.69) PRKCDCAMK2BCAMK2GAURKBMCL1
SCHEMBL4162155 0.85 MCL1 (1.00) PRKCDCAMK2BCAMK2GAURKBMCL1
SCHEMBL4170531 0.85 PRKCD (0.71) PRKCDCAMK2BCAMK2GAURKBMCL1

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2134684-B1 7-SUBSTITUTED INDOLE AS MCL-1 INHIBITORS ABBVIE INC (US) 2017-08-02 EP claimed
US-20140051683-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS ABBVIE INC. (US) 2014-02-20 US claimed
US-8445679-B2 7-substituted indole MCL-1 inhibitors ABBVIE INC. (US) 2013-05-21 US claimed
EP-2134684-A2 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS Abbott Laboratories (US) 2009-12-23 EP claimed
US-20090054402-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS ABBOTT LABORATORIES (US) 2009-02-26 US claimed
WO-2008131000-A2 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS ABBOTT LABORATORIES (US) 2008-10-30 WO claimed
EP-3243814-B1 7-SUBSTITUTED INDOLE AS MCL-1 INHIBITORS ABBVIE INC (US) 2018-10-17 EP disclosed
EP-3243814-A1 7-SUBSTITUTED INDOLE AS MCL-1 INHIBITORS AbbVie Inc. (US) 2017-11-15 EP disclosed
EP-2134684-B1 7-SUBSTITUTED INDOLE AS MCL-1 INHIBITORS ABBVIE INC (US) 2017-08-02 EP disclosed
US-9359296-B2 7-substituted indole Mcl-1 inhibitors ABBVIE INC. (US) 2016-06-07 US disclosed
US-20150284328-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS ABBVIE INC (US) 2015-10-08 US disclosed
US-9035047-B2 7-substituted indole Mcl-1 inhibitors ABBVIE INC. (US) 2015-05-19 US disclosed
US-20140051683-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS ABBVIE INC. (US) 2014-02-20 US disclosed
US-8445679-B2 7-substituted indole MCL-1 inhibitors ABBVIE INC. (US) 2013-05-21 US disclosed
US-20090054402-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS ABBOTT LABORATORIES (US) 2009-02-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140051683-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, API5 PRKCD 2091/4885CAMK2B 812/4885CAMK2G 607/4885
US-20150284328-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, API5 PRKCD 2091/4885CAMK2B 812/4885CAMK2G 607/4885
US-20090054402-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, API5 PRKCD 2091/4885CAMK2B 812/4885CAMK2G 607/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.