SCHEMBL20604942

SCHEMBL20604942

COCCn1cc(I)c2cc(-c3ncn(CC4CCOCC4)n3)ccc21

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 5/20 0.46
▸ CNR2 P34972 9/20 0.38
▸ CNR1 P21554 5/20 0.38
▸ CDK9 P50750 1/20 0.34
▸ HTR1A P08908 1/20 0.33
▸ DRD4 P21917 1/20 0.33
▸ HTR1B P28222 1/20 0.33
▸ DRD3 P35462 1/20 0.33
▸ HTR6 P50406 1/20 0.33
▸ KDM1A O60341 1/20 0.33

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 0.94 MCL1 (0.44) MCL1CNR1
SCHEMBL23809526 0.90 MCL1 (0.49) MCL1CNR2CNR1
SCHEMBL23799369 0.87 MCL1 (0.39) MCL1CNR1CDK9KDM1A
SCHEMBL20604991 0.85 MCL1 (0.45) MCL1CNR2
SCHEMBL20604843 0.84 MCL1 (0.42) MCL1CNR2CNR1
SCHEMBL30790922 0.83 MCL1 (0.49) MCL1CNR2CNR1
SCHEMBL20604810 0.83 MCL1 (0.49) MCL1CNR2CNR1
SCHEMBL20604962 0.83 MCL1 (0.43) MCL1CNR2CNR1
SCHEMBL26581596 0.83 MCL1 (0.47) MCL1CNR1
SCHEMBL20604830 0.81 DYRK1A (0.35) MCL1CNR2CNR1

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 1/4885CNR2 3259/4885CNR1 2722/4885
US-12144816-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL9 MCL1 1/4885CNR2 3259/4885CNR1 2722/4885
US-20230330099-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL9 MCL1 1/4885CNR2 3259/4885CNR1 2722/4885
US-11596639-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL9 MCL1 1/4885CNR2 3259/4885CNR1 2722/4885

“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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