SCHEMBL20604841

SCHEMBL20604841

Cn1ccc2cc(-c3cncnc3)ccc21

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.51
PRKCI P41743 1/20 0.49
LRRK2 Q5S007 1/20 0.48
CCNC P24863 2/20 0.46
CDK8 P49336 2/20 0.46
FAAH O00519 7/20 0.46
PIK3CB P42338 1/20 0.45
CYP2A6 P11509 1/20 0.45
MAOB P27338 1/20 0.45
APP P05067 1/20 0.45
CLK4 Q9HAZ1 1/20 0.45
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 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
SCHEMBL7988012 0.86 CYP2A6 (0.45) HSD11B1PIK3CBCYP2A6
SCHEMBL23187978 0.82 CYP11B2 (0.64) HSD11B1CCNCCDK8FAAHCYP2A6
SCHEMBL3348340 0.81 PRKCI (0.56) HSD11B1PRKCILRRK2CCNCCDK8
SCHEMBL18029323 0.81 HSD11B1 (0.53) HSD11B1PRKCILRRK2CCNCCDK8
Hydrochloric Acid SCHEMBL14909693 0.80 PRKCI (0.54) HSD11B1PRKCILRRK2CCNCCDK8
SCHEMBL14923422 0.77 FAAH (0.47) HSD11B1PRKCILRRK2CCNCCDK8
SCHEMBL19662764 0.77 LRRK2 (0.70) HSD11B1PRKCILRRK2FAAHPIK3CB
SCHEMBL13786855 0.77 HSD11B1 (0.55) HSD11B1PRKCILRRK2FAAHCYP2A6
SCHEMBL30241674 0.77 HSD11B1 (0.69) HSD11B1PRKCILRRK2FAAHCYP2A6
SCHEMBL5256926 0.77 HSD11B1 (0.69) HSD11B1PRKCILRRK2FAAHCYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12144816-B2 Substituted indole Mcl-1 inhibitors VANDERBILT UNIVERSITY (US) 2024-11-19 US disclosed
EP-4292662-A2 SUBSTITUTED INDOLE MCL-1 INHIBITORS Vanderbilt University (US) 2023-12-20 EP disclosed
US-20230330099-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2023-10-19 US disclosed
EP-3423435-B1 SUBSTITUTED INDOLE MCL-1 INHIBITORS UNIV VANDERBILT (US) 2023-08-23 EP disclosed
US-11596639-B2 Substituted indole Mcl-1 inhibitors VANDERBILT UNIVERSITY (US) 2023-03-07 US disclosed
CN-109153643-B Substituted indole MCL-1 inhibitors 范德比尔特大学 2022-06-21 CN disclosed
US-20210283138-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS VANDERBILT UNIVERSITY 2021-09-16 US disclosed
EP-3423435-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS Vanderbilt University (US) 2019-01-09 EP 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 (4 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-20210283138-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL9 HSD11B1 4071/4885PRKCI 444/4885LRRK2 52/4885
US-12144816-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL9 HSD11B1 4071/4885PRKCI 444/4885LRRK2 52/4885
US-20230330099-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL9 HSD11B1 4071/4885PRKCI 444/4885LRRK2 52/4885
US-11596639-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL9 HSD11B1 4071/4885PRKCI 444/4885LRRK2 52/4885

“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.