SCHEMBL914010

SCHEMBL914010

COc1cc2nc(-c3ccc(Cl)c(Cl)c3)oc(=O)c2cc1OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.58
ALDH1A1 P00352 3/20 0.58
HPGD P15428 2/20 0.58
NPC1 O15118 1/20 0.58
KLK7 P49862 8/20 0.57
KLK14 Q9P0G3 8/20 0.57
KLK5 Q9Y337 8/20 0.57
CTSG P08311 6/20 0.57
HSD17B10 Q99714 2/20 0.57
CTRC Q99895 2/20 0.57
KMT2A Q03164 2/20 0.57
MAPT P10636 1/20 0.57
PTK2B Q14289 1/20 0.57
MEN1 O00255 1/20 0.57
MAPK1 P28482 1/20 0.56
PDGFRB P09619 1/20 0.52
PDGFRA P16234 1/20 0.52
POLB P06746 1/20 0.51
ELANE P08246 3/20 0.49
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL22952908 0.88 KLK7 (0.67) KDM4EALDH1A1HPGDNPC1KLK7
SCHEMBL914160 0.87 KLK7 (0.60) KDM4EALDH1A1HPGDNPC1KLK7
SCHEMBL913598 0.85 ALDH1A1 (0.51) KDM4EALDH1A1HPGDNPC1KLK7
SCHEMBL914308 0.83 KMT2A (0.65) KDM4EALDH1A1HPGDNPC1KLK7
SCHEMBL915062 0.83 KMT2A (0.64) KDM4EALDH1A1HPGDNPC1KLK7
SCHEMBL17554019 0.83 KLK7 (0.72) KDM4EALDH1A1HPGDNPC1KLK7
SCHEMBL8499615 0.81 KMT2A (0.70) KDM4EALDH1A1HPGDNPC1KLK7
SCHEMBL914043 0.80 HSD17B10 (0.63) KDM4EALDH1A1HPGDNPC1KLK7
SCHEMBL912875 0.80 KLK7 (0.85) KDM4EALDH1A1HPGDKLK7KLK14
SCHEMBL913577 0.79 ELANE (0.56) KDM4EALDH1A1HPGDNPC1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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
WO-1999048878-A1 HETEROCYCLIC COMPOUNDS REGULATING CLOTTING NOVO NORDISK A/S (DK) 1999-09-30 WO 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 KDM4E 1362/4885ALDH1A1 584/4885HPGD 73/4885

“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.