SCHEMBL23799369

SCHEMBL23799369

COCCn1cc(I)c2cc(-c3ncn(CC4CNC4)n3)ccc21

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 8/20 0.39
▸ DYRK1A Q13627 2/20 0.32
▸ CCNT1 O60563 1/20 0.31
▸ CDK7 P50613 1/20 0.31
▸ CDK9 P50750 1/20 0.31
▸ CCNH P51946 1/20 0.31
▸ MNAT1 P51948 1/20 0.31
▸ KDM1A O60341 1/20 0.31
▸ CNR1 P21554 1/20 0.31
▸ NFATC1 O95644 1/20 0.30
▸ GSK3B P49841 1/20 0.30
▸ PTGER4 P35408 2/20 0.30
▸ XDH P47989 1/20 0.30
▸ RIPK1 Q13546 1/20 0.30

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
SCHEMBL20605018 0.92 MCL1 (0.44) MCL1DYRK1ACNR1PTGER4RIPK1
SCHEMBL20604942 0.87 MCL1 (0.46) MCL1CDK9KDM1ACNR1
SCHEMBL20604962 0.85 MCL1 (0.43) MCL1CNR1PTGER4XDHRIPK1
SCHEMBL30790922 0.85 MCL1 (0.49) MCL1CNR1PTGER4XDHRIPK1
SCHEMBL20604810 0.85 MCL1 (0.49) MCL1CNR1PTGER4XDHRIPK1
SCHEMBL20604830 0.82 DYRK1A (0.35) MCL1DYRK1ACNR1NFATC1GSK3B
SCHEMBL20605746 0.82 MCL1 (0.41) MCL1CDK9PTGER4
SCHEMBL30790899 0.82 MCL1 (0.41) MCL1CDK9PTGER4
SCHEMBL20604886 0.81 DRD2 (0.38) MCL1DYRK1ACNR1NFATC1GSK3B
SCHEMBL26581596 0.81 MCL1 (0.47) MCL1DYRK1ACNR1PTGER4

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 7 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

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 1/4885DYRK1A 1867/4885CCNT1 1887/4885
US-12144816-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL9 MCL1 1/4885DYRK1A 1867/4885CCNT1 1887/4885
US-20230330099-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL9 MCL1 1/4885DYRK1A 1867/4885CCNT1 1887/4885
US-11596639-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL9 MCL1 1/4885DYRK1A 1867/4885CCNT1 1887/4885

“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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