SCHEMBL23924845

SCHEMBL23924845

COC(=O)C1(NC(=O)C(N)Cc2ccc(NC(=O)OCC3c4ccccc4-c4ccccc43)cc2)CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 1/20 0.43
▸ KMT2A Q03164 2/20 0.38
▸ FAAH O00519 2/20 0.36
▸ TRPV1 Q8NER1 2/20 0.36
▸ CTSL P07711 1/20 0.35
▸ CTSB P07858 1/20 0.35
▸ CTSS P25774 1/20 0.35
▸ CTSK P43235 1/20 0.35
▸ BMP1 P13497 1/20 0.35
▸ CA12 O43570 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ CASP3 P42574 1/20 0.34
▸ BCHE P06276 1/20 0.34
▸ ACHE P22303 1/20 0.34
▸ ROCK2 O75116 1/20 0.34
▸ ROCK1 Q13464 1/20 0.34
▸ LCK P06239 1/20 0.34
▸ GRB2 P62993 1/20 0.34

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
SCHEMBL23924843 1.00 EPHX2 (0.43) EPHX2KMT2AFAAHTRPV1CTSL
SCHEMBL23925185 0.97 EPHX2 (0.43) EPHX2KMT2ABMP1CA12CA1
SCHEMBL23925183 0.97 EPHX2 (0.43) EPHX2KMT2ABMP1CA12CA1
SCHEMBL21683185 0.86 EPHX2 (0.43) EPHX2KMT2AFAAHTRPV1CA12
SCHEMBL23924902 0.85 MDM2 (0.44) EPHX2CTSLCTSBCTSSCTSK
SCHEMBL23924903 0.85 MDM2 (0.44) EPHX2CTSLCTSBCTSSCTSK
SCHEMBL21683248 0.84 EPHX2 (0.43) EPHX2KMT2ACA12CA1CA2
SCHEMBL23925017 0.82 MDM2 (0.45) EPHX2CTSLCTSBCTSSCTSK
SCHEMBL23925019 0.82 MDM2 (0.45) EPHX2CTSLCTSBCTSSCTSK
SCHEMBL15160753 0.81 EPHX2 (0.54) EPHX2KMT2ACA12CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11505531-B2 Piperazine-2,5-diones as TGF-beta inhibitors UAB RESEARCH FOUNDATION (US) 2022-11-22 — — US disclosed
US-20210323933-A1 PIPERAZINE-2,5-DIONES AS TGF-BETA INHIBITORS UAB RESEARCH FOUNDATION (US) 2021-10-21 — — 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 (2 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-20210323933-A1 PIPERAZINE-2,5-DIONES AS TGF-BETA INHIBITORS TGFBR2, SMAD2, TGFB2 EPHX2 3587/4885KMT2A 1099/4885FAAH 4412/4885
US-11505531-B2 Piperazine-2,5-diones as TGF-beta inhibitors TGFBR2, SMAD2, TGFB2 EPHX2 3587/4885KMT2A 1099/4885FAAH 4412/4885

“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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