SCHEMBL916119

SCHEMBL916119

O=c1oc(-c2cccnc2Cl)nc2cc(F)c(F)cc12

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.55
F10 P00742 2/20 0.51
F7 P08709 2/20 0.51
F3 P13726 2/20 0.51
F2 P00734 1/20 0.51
C1R P00736 6/20 0.50
KLK7 P49862 5/20 0.47
KLK14 Q9P0G3 5/20 0.47
KLK5 Q9Y337 5/20 0.47
CTSG P08311 4/20 0.47
PRSS1 P07477 1/20 0.47
ELANE P08246 4/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL915773 0.81 C1R (0.73) APEX1F10F7F3F2
SCHEMBL914180 0.81 APEX1 (0.56) APEX1F10F7F3C1R
SCHEMBL913737 0.79 C1R (0.57) APEX1F10F7F3F2
SCHEMBL914529 0.77 APEX1 (0.65) APEX1F7F3F2C1R
SCHEMBL914380 0.74 C1R (0.70) APEX1C1RKLK7KLK14KLK5
SCHEMBL913631 0.74 F7 (0.67) APEX1F10F7F3F2
SCHEMBL4850801 0.74 ELANE (0.66) APEX1F2C1RELANEMEN1
SCHEMBL913679 0.72 CTSG (0.51) APEX1F10F7F3C1R
SCHEMBL913650 0.72 ELANE (0.77) C1RELANE
SCHEMBL915740 0.71 APEX1 (1.00) APEX1F10F7F3F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7872052-B2 Use of heterocyclic compounds as SCCE inhibitors AREXIS AB (SE) 2011-01-18 US disclosed
US-20060258651-A1 Use of heterocyclic compounds as scce inhibitors QUANTUM LTO HOLDINGS, LLC 2006-11-16 US disclosed
EP-1631295-A2 USE OF FUSED HETEROCYCLIC COMPOUNDS AS SCCE INHIBITORS FOR THE TREATMENT OF SKIN CONDITIONS OR CANCER Arexis AB (SE) 2006-03-08 EP disclosed
WO-2004108139-A2 USE OF FUSED HETEROCYCLIC COMPOUNDS AS SCCE INHIBITORS FOR THE TREATMENT OF SKIN CONDITIONS OR CANCER AREXIS AB (SE) 2004-12-16 WO disclosed
US-6180625-B1 MODULATING AND NORMALIZING AN IMPAIRED HAEMOSTATIC BALANCE IN A MAMMAL, WHICH METHOD COMPRISES ADMINISTERING AN EFFECTIVE AMOUNT OF NOVEL BENZOXAZIN DERIVATIVES; ANTICOAGULANTS NOVO NORDISK A/S (DK) 2001-01-30 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 (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-20060258651-A1 Use of heterocyclic compounds as scce inhibitors RCE1, CTSE, SPINT2 APEX1 1422/4885F10 937/4885F7 3152/4885

“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.