SCHEMBL31090550

SCHEMBL31090550

COC(=O)c1cccc2c1nc(C)n2CCOCCCBr

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.39
▸ MAPT P10636 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ PKN1 Q16512 1/20 0.38
▸ PKN2 Q16513 1/20 0.38
▸ LCK P06239 1/20 0.37
▸ PTGER4 P35408 2/20 0.36
▸ RIPK1 Q13546 1/20 0.36
▸ PIK3CB P42338 1/20 0.36
▸ GAA P10253 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ PTGDR2 Q9Y5Y4 1/20 0.35

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
SCHEMBL24744943 1.00 KDM4E (0.39) KDM4EMAPTALDH1A1PKN1PKN2
SCHEMBL31090578 0.91 MAPT (0.41) KDM4EMAPTALDH1A1PKN1PKN2
SCHEMBL24745617 0.91 MAPT (0.41) KDM4EMAPTALDH1A1PKN1PKN2
SCHEMBL31090561 0.90 SMN1; SMN2 (0.41) KDM4EMAPTALDH1A1PKN1PKN2
SCHEMBL24744939 0.90 SMN1; SMN2 (0.41) KDM4EMAPTALDH1A1PKN1PKN2
SCHEMBL24745731 0.86 KDM4E (0.42) KDM4EMAPTALDH1A1PKN1PKN2
SCHEMBL31090549 0.86 MAPT (0.41) KDM4EMAPTALDH1A1PKN1PKN2
SCHEMBL24744940 0.86 MAPT (0.41) KDM4EMAPTALDH1A1PKN1PKN2
SCHEMBL24744938 0.85 TLR8 (0.42) KDM4EMAPTALDH1A1GAAKMT2A
SCHEMBL31090560 0.85 TLR8 (0.42) KDM4EMAPTALDH1A1GAAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240294499-A1 TARGETED PROTEIN DEGRADATION USING BIFUNCTIONAL COMPOUNDS THAT BIND UBIQUITIN LIGASE AND TARGET MCL-1 PROTEIN CAPTOR THERAPEUTICS S.A. (PL) 2024-09-05 — — 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 (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-20240294499-A1 TARGETED PROTEIN DEGRADATION USING BIFUNCTIONAL COMPOUNDS THAT BIND UBIQUITIN LIGASE AND TARGET MCL-1 PROTEIN MCL1, MDM2, XIAP KDM4E 1943/4885MAPT 1918/4885ALDH1A1 956/4885

“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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