SCHEMBL4156873

SCHEMBL4156873

Cc1ccccc1-c1cccc2c(CCCOc3cccc(Cl)c3Cl)c(C(=O)O)n(Cc3ccccn3)c12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 18/20 0.53
ALB P02768 2/20 0.53
MARK3 P27448 2/20 0.44
IRAK1 P51617 2/20 0.44
NEK4 P51957 2/20 0.44
MAP4K2 Q12851 2/20 0.44
CAMK2B Q13554 2/20 0.44
CAMK2G Q13555 2/20 0.44
CAMK2D Q13557 2/20 0.44
MARK2 Q7KZI7 2/20 0.44
TAOK1 Q7L7X3 2/20 0.44
PIM3 Q86V86 2/20 0.44
MINK1 Q8N4C8 2/20 0.44
HIPK4 Q8NE63 2/20 0.44
PRKD2 Q9BZL6 2/20 0.44
HIPK2 Q9H2X6 2/20 0.44
MAP3K20 Q9NYL2 2/20 0.44
JAK2 O60674 1/20 0.44
ERBB2 P04626 1/20 0.44
PLK1 P53350 1/20 0.44

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
SCHEMBL19180326 0.89 MCL1 (0.45) MCL1ALBMARK3IRAK1NEK4
SCHEMBL4161999 0.89 MCL1 (0.66) MCL1ALBMARK3IRAK1NEK4
SCHEMBL4154300 0.79 MCL1 (0.66) MCL1ALBMARK3IRAK1NEK4
SCHEMBL4175214 0.79 MCL1 (0.56) MCL1ALBMARK3IRAK1NEK4
SCHEMBL19180691 0.78 MCL1 (0.55) MCL1ALBMARK3IRAK1NEK4
SCHEMBL4160531 0.78 MCL1 (0.56) MCL1ALBMARK3IRAK1NEK4
SCHEMBL4163013 0.77 MCL1 (0.68) MCL1ALBMARK3IRAK1NEK4
SCHEMBL4164201 0.77 MCL1 (0.70) MCL1ALBMARK3IRAK1NEK4
SCHEMBL4154214 0.76 MCL1 (0.67) MCL1ALBMARK3IRAK1NEK4
SCHEMBL4165618 0.76 MCL1 (0.67) MCL1ALBMARK3IRAK1NEK4

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 13 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
US-20090054402-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS ABBOTT LABORATORIES (US) 2009-02-26 US 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 MCL1 1/4885ALB 3819/4885MARK3 2332/4885
US-20150284328-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, API5 MCL1 1/4885ALB 3819/4885MARK3 2332/4885
US-20090054402-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, API5 MCL1 1/4885ALB 3819/4885MARK3 2332/4885

“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.