SCHEMBL26480287

SCHEMBL26480287

Cc1cc(CO)ccc1-c1nc2cc3c(cc2c(=O)o1)OCCO3

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KLK7 P49862 12/20 0.56
▸ CTSG P08311 11/20 0.56
▸ KLK14 Q9P0G3 11/20 0.56
▸ KLK5 Q9Y337 11/20 0.56
▸ PRSS1 P07477 4/20 0.56
▸ CTRC Q99895 4/20 0.52
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ PKM P14618 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ PDCD1 Q15116 1/20 0.38
▸ CD274 Q9NZQ7 1/20 0.38
▸ C1R P00736 2/20 0.37
▸ F2 P00734 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
SCHEMBL26480338 0.91 KLK7 (0.56) KLK7CTSGKLK14KLK5PRSS1
SCHEMBL29838606 0.85 KLK7 (0.70) KLK7CTSGKLK14KLK5PRSS1
SCHEMBL23159922 0.85 KLK7 (0.70) KLK7CTSGKLK14KLK5PRSS1
SCHEMBL23159923 0.83 KLK7 (0.70) KLK7CTSGKLK14KLK5PRSS1
SCHEMBL26480268 0.83 KLK7 (0.59) KLK7CTSGKLK14KLK5PRSS1
SCHEMBL26480280 0.81 KLK7 (0.57) KLK7CTSGKLK14KLK5PRSS1
SCHEMBL26480275 0.80 KLK7 (0.56) KLK7CTSGKLK14KLK5PRSS1
SCHEMBL26480185 0.75 KLK7 (0.72) KLK7CTSGKLK14KLK5PRSS1
SCHEMBL26480336 0.74 KLK7 (0.57) KLK7CTSGKLK14KLK5PRSS1
SCHEMBL26480329 0.73 KLK7 (0.56) 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 2 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-11643420-B2 Benzoxazinone compounds as KLK5/7 dual inhibitors MOLECULAR SKIN THERAPEUTICS, INC. (US) 2023-05-09 — — 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-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

“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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