SCHEMBL4170743

SCHEMBL4170743

Cc1ccc2c(c1)CCCN2CCCCc1c(C(=O)O)[nH]c2c(-c3ccc(C(=O)N4CCOCC4)cc3C(F)(F)F)cccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 8/20 0.38
RORC P51449 2/20 0.37
CDC7 O00311 1/20 0.35
MARK3 P27448 1/20 0.35
AXL P30530 1/20 0.35
FRK P42685 1/20 0.35
BLK P51451 1/20 0.35
NEK4 P51957 1/20 0.35
PRKCD Q05655 1/20 0.35
MAP4K2 Q12851 1/20 0.35
CAMK2B Q13554 1/20 0.35
CAMK2G Q13555 1/20 0.35
CAMK2D Q13557 1/20 0.35
CDC42BPA Q5VT25 1/20 0.35
MARK2 Q7KZI7 1/20 0.35
TAOK1 Q7L7X3 1/20 0.35
PIM3 Q86V86 1/20 0.35
MINK1 Q8N4C8 1/20 0.35
HIPK4 Q8NE63 1/20 0.35
BRSK1 Q8TDC3 1/20 0.35

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
SCHEMBL4161321 0.93 MCL1 (0.41) MCL1RORCCDC7MARK3AXL
SCHEMBL4163053 0.92 L3MBTL1 (0.39) MCL1RORCKDM4ERAB9ACNR2
SCHEMBL4156731 0.89 RORC (0.35) MCL1RORCCDC7MARK3AXL
SCHEMBL4171899 0.89 MCL1 (0.39) MCL1RORCCDC7MARK3AXL
SCHEMBL4168704 0.88 PDCD1 (0.38) MCL1RORCCDC7MARK3AXL
SCHEMBL4166306 0.87 KDM4E (0.39) MCL1RORCKDM4ERAB9A
SCHEMBL4174801 0.84 PDCD1 (0.37) MCL1RORCCDC7MARK3AXL
SCHEMBL4158209 0.83 ALDH1A1 (0.37) MCL1RORCCDC7MARK3AXL
SCHEMBL4175502 0.81 MCL1 (0.38) MCL1CDC7MARK3AXLFRK
SCHEMBL4168681 0.81 PDCD1 (0.37) MCL1RORCCDC7MARK3AXL

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-3243814-B1 7-SUBSTITUTED INDOLE AS MCL-1 INHIBITORS ABBVIE INC (US) 2018-10-17 EP claimed
EP-3243814-A1 7-SUBSTITUTED INDOLE AS MCL-1 INHIBITORS AbbVie Inc. (US) 2017-11-15 EP claimed
US-9359296-B2 7-substituted indole Mcl-1 inhibitors ABBVIE INC. (US) 2016-06-07 US claimed
US-20150284328-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS ABBVIE INC (US) 2015-10-08 US claimed
US-20140051683-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS ABBVIE INC. (US) 2014-02-20 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 1/4885RORC 3088/4885CDC7 86/4885
US-20150284328-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, API5 MCL1 1/4885RORC 3088/4885CDC7 86/4885
US-20090054402-A1 7-SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, API5 MCL1 1/4885RORC 3088/4885CDC7 86/4885

“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.