SCHEMBL20605117

SCHEMBL20605117

CN1CCN(CCn2cc(I)c3cc(-c4ncn(C)n4)ccc32)CC1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 6/20 0.43
▸ HTR1A P08908 5/20 0.40
▸ DRD4 P21917 5/20 0.40
▸ HTR1B P28222 5/20 0.40
▸ DRD3 P35462 4/20 0.40
▸ DRD2 P14416 2/20 0.38
▸ HTR2A P28223 1/20 0.38
▸ HTR2C P28335 1/20 0.37
▸ BRD4 O60885 1/20 0.33
▸ CREBBP Q92793 1/20 0.33
▸ LRRK2 Q5S007 1/20 0.32
▸ PRKAB2 O43741 1/20 0.31
▸ PRKAG1 P54619 1/20 0.31
▸ PRKAA2 P54646 1/20 0.31
▸ PRKAA1 Q13131 1/20 0.31
▸ PRKAG3 Q9UGI9 1/20 0.31
▸ PRKAG2 Q9UGJ0 1/20 0.31
▸ PRKAB1 Q9Y478 1/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ PIK3CD O00329 1/20 0.31

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
SCHEMBL30790891 1.00 MCL1 (0.43) MCL1HTR1ADRD4HTR1BDRD3
SCHEMBL23809281 0.87 MCL1 (0.42) MCL1HTR1ADRD4HTR1BDRD3
SCHEMBL20604964 0.87 HTR1A (0.46) MCL1HTR1ADRD4HTR1BDRD3
SCHEMBL20604925 0.86 HTR1A (0.42) MCL1HTR1ADRD4HTR1BDRD3
SCHEMBL30790895 0.86 HTR1A (0.42) MCL1HTR1ADRD4HTR1BDRD3
SCHEMBL20604923 0.84 HTR1A (0.44) MCL1HTR1ADRD4HTR1BDRD3
SCHEMBL20604926 0.79 DRD2 (0.39) HTR1ADRD4HTR1BDRD3DRD2
SCHEMBL20604874 0.79 DRD2 (0.41) HTR1ADRD4HTR1BDRD3DRD2
SCHEMBL20604886 0.77 DRD2 (0.38) MCL1HTR1ADRD4HTR1BDRD3
SCHEMBL20604943 0.75 GRIN2B (0.43) MCL1

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 MCL1 1/4885HTR1A 2199/4885DRD4 4430/4885
US-12144816-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL9 MCL1 1/4885HTR1A 2199/4885DRD4 4430/4885
US-20230330099-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL9 MCL1 1/4885HTR1A 2199/4885DRD4 4430/4885
US-11596639-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL9 MCL1 1/4885HTR1A 2199/4885DRD4 4430/4885

“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.

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