SCHEMBL914390

SCHEMBL914390

COc1cc2c(=O)oc(-c3cccnc3Oc3ccccc3)nc2c(OC)c1OC

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 6/20 0.62
▸ C1R P00736 2/20 0.45
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ KLK7 P49862 9/20 0.43
▸ KLK14 Q9P0G3 9/20 0.43
▸ KLK5 Q9Y337 9/20 0.43
▸ CTSG P08311 7/20 0.43
▸ CTRC Q99895 2/20 0.42
▸ PRSS1 P07477 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.38

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
SCHEMBL17554069 0.79 C1R (0.52) ELANEC1RMEN1KMT2AKLK7
SCHEMBL12897219 0.77 ELANE (1.00) ELANEC1RMEN1KMT2APRSS1
SCHEMBL8216128 0.76 ELANE (1.00) ELANEC1RKLK7KLK14KLK5
SCHEMBL17554078 0.73 MAPK1 (0.56) ELANEKDM4ENPC1ALDH1A1HPGD
SCHEMBL17554026 0.72 ALDH1A1 (0.55) MEN1KMT2AKLK7KLK14KLK5
SCHEMBL8068649 0.72 HSD17B10 (0.69) MEN1KMT2AKDM4ENPC1ALDH1A1
SCHEMBL8210841 0.71 ELANE (0.78) ELANEC1R
SCHEMBL12897182 0.70 ELANE (1.00) ELANEC1R
SCHEMBL12897215 0.70 ELANE (1.00) ELANEC1R
SCHEMBL708276 0.68 KDM4E (0.69) ELANEMEN1KMT2AKDM4ENPC1

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 3 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
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 ELANE 353/4885C1R 202/4885MEN1 1609/4885

“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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