SCHEMBL20604935

SCHEMBL20604935

COCCn1cc(I)c2cc(-c3nc[nH]n3)ccc21

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 2/20 0.37
▸ GSK3B P49841 2/20 0.36
▸ NFATC1 O95644 1/20 0.36
▸ CNR1 P21554 3/20 0.36
▸ GRIN2B Q13224 1/20 0.34
▸ PTGER4 P35408 1/20 0.34
▸ XDH P47989 1/20 0.33
▸ CNR2 P34972 3/20 0.33
▸ PRKACA P17612 1/20 0.33
▸ PRKACG P22612 1/20 0.33
▸ PRKACB P22694 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CDK1 P06493 1/20 0.33
▸ CCNB1 P14635 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.32
▸ CHUK O15111 1/20 0.32

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
SCHEMBL20604878 0.84 DYRK1A (0.41) DYRK1AGSK3BNFATC1CNR1GRIN2B
SCHEMBL20604886 0.81 DRD2 (0.38) DYRK1AGSK3BNFATC1CNR1GRIN2B
SCHEMBL20604953 0.81 HASPIN (0.42) GSK3B
SCHEMBL23800169 0.80 CNR2 (0.39) DYRK1AGSK3BNFATC1CNR1CNR2
SCHEMBL20604830 0.77 DYRK1A (0.35) DYRK1AGSK3BNFATC1CNR1GRIN2B
SCHEMBL20605018 0.75 MCL1 (0.44) DYRK1ACNR1PTGER4
SCHEMBL23799369 0.75 MCL1 (0.39) DYRK1AGSK3BNFATC1CNR1PTGER4
SCHEMBL23800568 0.73 MCL1 (0.44) DYRK1AGSK3BNPSR1
SCHEMBL23800535 0.73 MCL1 (0.33) DYRK1AGSK3BNFATC1CNR1
SCHEMBL20604991 0.73 MCL1 (0.45) GSK3BPTGER4CNR2NPSR1

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 DYRK1A 1867/4885GSK3B 196/4885NFATC1 79/4885
US-12144816-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL9 DYRK1A 1867/4885GSK3B 196/4885NFATC1 79/4885
US-20230330099-A1 SUBSTITUTED INDOLE MCL-1 INHIBITORS MCL1, BCL2L1, BCL9 DYRK1A 1867/4885GSK3B 196/4885NFATC1 79/4885
US-11596639-B2 Substituted indole Mcl-1 inhibitors MCL1, BCL2L1, BCL9 DYRK1A 1867/4885GSK3B 196/4885NFATC1 79/4885

“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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