SCHEMBL20745622

SCHEMBL20745622

COCC1(c2nccc(C(OC)OC)n2)CC1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ KMT2A Q03164 4/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ MAPT P10636 2/20 0.34
▸ KDM4C Q9H3R0 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
SCHEMBL20745907 0.94 L3MBTL1 (0.36) L3MBTL1SMN1; SMN2KMT2ARAB9AMAPT
SCHEMBL20745356 0.87 L3MBTL1 (0.34) L3MBTL1SMN1; SMN2KMT2ARAB9AMAPT
SCHEMBL20745118 0.85 SMN1; SMN2 (0.40) L3MBTL1SMN1; SMN2KMT2ARAB9AMAPT
SCHEMBL22262359 0.82 CHRM2 (0.34) L3MBTL1SMN1; SMN2KMT2ARAB9AMAPT
SCHEMBL20745578 0.82 CHRM2 (0.34) L3MBTL1SMN1; SMN2KMT2ARAB9AMAPT
SCHEMBL22262930 0.82 CHRM2 (0.34) L3MBTL1SMN1; SMN2KMT2ARAB9AMAPT
SCHEMBL22262597 0.82 CHRM2 (0.34) L3MBTL1SMN1; SMN2KMT2ARAB9AMAPT
SCHEMBL20745446 0.80 SMN1; SMN2 (0.39) L3MBTL1SMN1; SMN2KMT2ARAB9AMAPT
SCHEMBL20745437 0.80 SMN1; SMN2 (0.39) L3MBTL1SMN1; SMN2KMT2ARAB9AMAPT
SCHEMBL20745088 0.79 SMN1; SMN2 (0.38) L3MBTL1SMN1; SMN2KMT2ARAB9AMAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112739343-A Macrocyclic MCL-1 inhibitors and methods of use 艾伯维公司 2021-04-30 — — CN disclosed
US-20200255451-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE ABBVIE INC (US) 2020-08-13 — — US disclosed
EP-3668504-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE AbbVie Inc. (US) 2020-06-24 — — EP disclosed
WO-2019035914-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 (1 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-20200255451-A1 MACROCYCLIC MCL-1 INHIBITORS AND METHODS OF USE MCL1, BCL2A1, BCL2L10 L3MBTL1 76/4885SMN1; SMN2 609/4885KMT2A 1375/4885

“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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