SCHEMBL20745058

SCHEMBL20745058

COC(OC)c1ccnc(-c2ccc(O)cc2)n1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.68
▸ KMT2A Q03164 13/20 0.61
▸ MAPT P10636 7/20 0.61
▸ RAB9A P51151 5/20 0.60
▸ L3MBTL1 Q9Y468 2/20 0.55
▸ MEN1 O00255 9/20 0.55
▸ NPC1 O15118 7/20 0.55
▸ ATM Q13315 1/20 0.47
▸ SCN9A Q15858 1/20 0.40
▸ USP2 O75604 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ NFKB1 P19838 1/20 0.38
▸ NFKB2 Q00653 1/20 0.38
▸ RELA Q04206 1/20 0.38
▸ IDH1 O75874 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ PRNP P04156 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ GAA P10253 1/20 0.38

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
SCHEMBL16816242 0.84 SMN1; SMN2 (0.63) SMN1; SMN2KMT2AMAPTRAB9AL3MBTL1
SCHEMBL16815686 0.83 SMN1; SMN2 (0.62) SMN1; SMN2KMT2AMAPTRAB9AL3MBTL1
SCHEMBL20745566 0.81 SMN1; SMN2 (0.60) SMN1; SMN2KMT2AMAPTRAB9AL3MBTL1
SCHEMBL20513851 0.78 SMN1; SMN2 (0.64) SMN1; SMN2KMT2AMAPTRAB9AL3MBTL1
SCHEMBL16815495 0.76 SMN1; SMN2 (0.55) SMN1; SMN2KMT2AMAPTRAB9AL3MBTL1
SCHEMBL14215338 0.75 SMN1; SMN2 (0.49) SMN1; SMN2KMT2AMAPTRAB9AL3MBTL1
SCHEMBL16815687 0.75 MAPT (0.52) SMN1; SMN2KMT2AMAPTRAB9AL3MBTL1
SCHEMBL16815276 0.75 SMN1; SMN2 (0.53) SMN1; SMN2KMT2AMAPTRAB9AL3MBTL1
SCHEMBL16815718 0.75 SMN1; SMN2 (0.53) SMN1; SMN2KMT2AMAPTRAB9AL3MBTL1
SCHEMBL20745064 0.75 SMN1; SMN2 (0.60) SMN1; SMN2KMT2AMAPTRAB9AL3MBTL1

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-20250313572-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE ABBVIE INC (US) 2025-10-09 — — US disclosed
US-20240228509-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE ABBVIE INC (US) 2024-07-11 — — US disclosed
US-20230399340-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE ABBVIE INC (US) 2023-12-14 — — US disclosed
CN-111818916-A Macrocyclic MCL-1 inhibitors and methods of use 艾伯维公司 2020-10-23 — — CN disclosed
US-20200239494-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE ABBVIE INC (US) 2020-07-30 — — US disclosed
EP-3668502-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE AbbVie Inc. (US) 2020-06-24 — — EP disclosed
WO-2019035927-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE ABBVIE INC. (US) 2019-02-21 — — WO 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-20240228509-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE MCL1, BCL2A1, BCL2L10 SMN1; SMN2 605/4885KMT2A 1365/4885MAPT 4497/4885
US-20200239494-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE MCL1, BCL2A1, BCL2L10 SMN1; SMN2 605/4885KMT2A 1365/4885MAPT 4497/4885
US-20250313572-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE MCL1, BCL2A1, BCL2L10 SMN1; SMN2 605/4885KMT2A 1365/4885MAPT 4497/4885
US-20230399340-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE MCL1, BCL2A1, BCL2L10 SMN1; SMN2 605/4885KMT2A 1365/4885MAPT 4497/4885

“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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