SCHEMBL21822553

SCHEMBL21822553

COC(=O)c1cc2ccc(C(=N)NC(=O)OC(C)(C)C)cc2n1Cc1cccc2cc(O)ccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NQO2 P16083 2/20 0.44
▸ KMT2A Q03164 1/20 0.36
▸ F10 P00742 8/20 0.36
▸ TRPV1 Q8NER1 2/20 0.35
▸ F2 P00734 2/20 0.34
▸ PRSS1 P07477 1/20 0.33
▸ CTSS P25774 1/20 0.33
▸ CTSK P43235 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MAPT P10636 2/20 0.33
▸ TP53 P04637 1/20 0.33
▸ MTNR1A P48039 1/20 0.33
▸ MTNR1B P49286 1/20 0.33
▸ OPRD1 P41143 1/20 0.32
▸ OPRK1 P41145 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ PDE4A P27815 1/20 0.32
▸ PDE4B Q07343 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
SCHEMBL21822737 0.85 CTSS (0.42) NQO2F10CTSSCTSK
SCHEMBL31689662 0.85 CTSS (0.42) NQO2F10CTSSCTSK
SCHEMBL25017969 0.84 MTNR1A (0.35) NQO2KMT2AF10F2PRSS1
SCHEMBL21822365 0.84 F10 (0.50) F10F2PRSS1
SCHEMBL21822112 0.83 NQO2 (0.37) NQO2F10CTSSCTSK
SCHEMBL31689687 0.83 NQO2 (0.37) NQO2F10CTSSCTSK
SCHEMBL25016833 0.80 KMT2A (0.41) KMT2AF10F2PRSS1LMNA
SCHEMBL30180863 0.79 EPHX1 (0.36) NQO2KMT2AF10CTSSCTSK
SCHEMBL25015964 0.79 CNR2 (0.39) NQO2F10CTSSCTSKSMN1; SMN2
SCHEMBL21822377 0.79 MCL1 (0.34) MTNR1AMTNR1B

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
US-20230043159-A1 MATRIPTASE 2 INHIBITORS AND USES THEREOF DISC MEDICINE, INC. 2023-02-09 — — US disclosed
EP-3860636-A1 MATRIPTASE 2 INHIBITORS AND USES THEREOF Disc Medicine, Inc. (US) 2021-08-11 — — EP disclosed
CN-112996529-A Matriptase 2 inhibitor and application thereof 迪斯克医药公司 2021-06-18 — — CN disclosed
WO-2020072580-A1 MATRIPTASE 2 INHIBITORS AND USES THEREOF DISC MEDICINE, INC. (US) 2020-04-09 — — 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-20230043159-A1 MATRIPTASE 2 INHIBITORS AND USES THEREOF MMP7, MATR3, SPINT2 NQO2 1416/4885KMT2A 1072/4885F10 1548/4885

“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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