SCHEMBL18353429

SCHEMBL18353429

O=c1oc(-c2ccccc2Cl)nc2cc3c(cc12)OCCCO3

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KLK7 P49862 10/20 1.00
▸ KLK14 Q9P0G3 9/20 1.00
▸ KLK5 Q9Y337 9/20 1.00
▸ CTSG P08311 8/20 1.00
▸ PRSS1 P07477 3/20 0.91
▸ CTRC Q99895 3/20 0.70
▸ C1R P00736 4/20 0.60
▸ ELANE P08246 2/20 0.52
▸ MEN1 O00255 2/20 0.49
▸ KMT2A Q03164 2/20 0.49
▸ MAPT P10636 1/20 0.49
▸ HTT P42858 1/20 0.49
▸ APEX1 P27695 1/20 0.47

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
SCHEMBL18352966 0.95 KLK7 (1.00) KLK7KLK14KLK5CTSGPRSS1
SCHEMBL18352858 0.82 KLK7 (1.00) KLK7KLK14KLK5CTSGPRSS1
SCHEMBL18353555 0.82 KLK7 (1.00) KLK7KLK14KLK5CTSGPRSS1
SCHEMBL18353430 0.81 KLK7 (1.00) KLK7KLK14KLK5CTSGPRSS1
SCHEMBL18352894 0.77 KLK7 (1.00) KLK7KLK14KLK5CTSGPRSS1
SCHEMBL23187443 0.77 KLK7 (0.68) KLK7KLK14KLK5CTSGPRSS1
SCHEMBL9984778 0.77 APEX1 (0.76) KLK7KLK14KLK5CTSGPRSS1
SCHEMBL18352896 0.76 KLK7 (1.00) KLK7KLK14KLK5CTSGPRSS1
SCHEMBL5780185 0.76 C1R (1.00) KLK7KLK14KLK5CTSGPRSS1
SCHEMBL912875 0.75 KLK7 (0.85) KLK7KLK14KLK5CTSGPRSS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20170267692-A1 BENZOXAZINONE DERIVATIVES FOR TREATMENT OF SKIN DISEASES KLK5, KLK14, KLK7 KLK7 3/4885KLK14 2/4885KLK5 1/4885
US-20170002021-A1 BENZOXAZINONE DERIVATIVES FOR TREATMENT OF SKIN DISEASES KLK5, KLK14, KLK7 KLK7 3/4885KLK14 2/4885KLK5 1/4885

“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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