SCHEMBL18352896

SCHEMBL18352896

CS(=O)(=O)c1ccccc1-c1nc2cc3c(cc2c(=O)o1)OCCO3

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KLK7 P49862 14/20 1.00
▸ CTSG P08311 13/20 1.00
▸ KLK14 Q9P0G3 13/20 1.00
▸ KLK5 Q9Y337 13/20 1.00
▸ PRSS1 P07477 4/20 1.00
▸ CTRC Q99895 4/20 0.91
▸ TP53 P04637 1/20 0.48
▸ C1R P00736 3/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45

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
SCHEMBL18353430 0.95 KLK7 (1.00) KLK7CTSGKLK14KLK5PRSS1
SCHEMBL22272045 0.86 KLK7 (0.79) KLK7CTSGKLK14KLK5PRSS1
SCHEMBL23159921 0.85 KLK7 (0.74) KLK7CTSGKLK14KLK5PRSS1
SCHEMBL29838660 0.85 KLK7 (0.74) KLK7CTSGKLK14KLK5PRSS1
SCHEMBL26480187 0.84 KLK7 (0.72) KLK7CTSGKLK14KLK5PRSS1
SCHEMBL23160011 0.84 KLK7 (0.72) KLK7CTSGKLK14KLK5PRSS1
SCHEMBL29838683 0.84 KLK7 (0.72) KLK7CTSGKLK14KLK5PRSS1
SCHEMBL26480185 0.84 KLK7 (0.72) KLK7CTSGKLK14KLK5PRSS1
SCHEMBL23159974 0.84 KLK7 (0.72) KLK7CTSGKLK14KLK5PRSS1
SCHEMBL23187341 0.83 KLK7 (0.71) KLK7CTSGKLK14KLK5PRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240067658-A1 BENZOXAZINONE COMPOUNDS AS KLK5/7 DUAL INHIBITORS ML Bio Solutions Inc. 2024-02-29 — — US disclosed
US-20240067658-A1 BENZOXAZINONE COMPOUNDS AS KLK5/7 DUAL INHIBITORS ML Bio Solutions Inc. 2024-02-29 — — US disclosed
US-11643420-B2 Benzoxazinone compounds as KLK5/7 dual inhibitors MOLECULAR SKIN THERAPEUTICS, INC. (US) 2023-05-09 — — US disclosed
US-11643420-B2 Benzoxazinone compounds as KLK5/7 dual inhibitors MOLECULAR SKIN THERAPEUTICS, INC. (US) 2023-05-09 — — US disclosed
WO-2021067335-A1 BENZOXAZINONE COMPOUNDS AS KLK5/7 DUAL INHIBITORS MOLECULAR SKIN THERAPEUTICS, INC. (US) 2021-04-08 — — WO disclosed
US-20210101911-A1 BENZOXAZINONE COMPOUNDS AS KLK5/7 DUAL INHIBITORS PHOENIX TISSUE REPAIR, INC. 2021-04-08 — — US disclosed
EP-3097085-B1 BENZOXAZINONE DERIVATIVES FOR TREATMENT OF SKIN DISEASES SIXERA PHARMA AB (SE) 2020-07-29 — — EP disclosed
US-20170267692-A1 BENZOXAZINONE DERIVATIVES FOR TREATMENT OF SKIN DISEASES SIXERA PHARMA AB (SE) 2017-09-21 — — US disclosed
US-20170267692-A1 BENZOXAZINONE DERIVATIVES FOR TREATMENT OF SKIN DISEASES SIXERA PHARMA AB (SE) 2017-09-21 — — US disclosed
US-9695194-B2 Benzoxazinone derivatives for treatment of skin diseases SIXERA PHARMA AB (SE) 2017-07-04 — — US disclosed
US-9695194-B2 Benzoxazinone derivatives for treatment of skin diseases SIXERA PHARMA AB (SE) 2017-07-04 — — US disclosed
US-20170002021-A1 BENZOXAZINONE DERIVATIVES FOR TREATMENT OF SKIN DISEASES SIXERA PHARMA AB (SE) 2017-01-05 — — US disclosed
US-20170002021-A1 BENZOXAZINONE DERIVATIVES FOR TREATMENT OF SKIN DISEASES SIXERA PHARMA AB (SE) 2017-01-05 — — 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 (5 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-20210101911-A1 BENZOXAZINONE COMPOUNDS AS KLK5/7 DUAL INHIBITORS KLK5, KLK1, KLK2 KLK7 4/4885CTSG 290/4885KLK14 6/4885
US-11643420-B2 Benzoxazinone compounds as KLK5/7 dual inhibitors KLK5, KLK1, KLK2 KLK7 4/4885CTSG 290/4885KLK14 6/4885
US-20240067658-A1 BENZOXAZINONE COMPOUNDS AS KLK5/7 DUAL INHIBITORS KLK5, KLK1, KLK2 KLK7 4/4885CTSG 290/4885KLK14 6/4885
US-20170267692-A1 BENZOXAZINONE DERIVATIVES FOR TREATMENT OF SKIN DISEASES KLK5, KLK14, KLK7 KLK7 3/4885CTSG 632/4885KLK14 2/4885
US-20170002021-A1 BENZOXAZINONE DERIVATIVES FOR TREATMENT OF SKIN DISEASES KLK5, KLK14, KLK7 KLK7 3/4885CTSG 632/4885KLK14 2/4885

“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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