SCHEMBL914131

SCHEMBL914131

COC(=O)c1cccc(-c2nc3cc(OC)c(OC)cc3c(=O)o2)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.55
MEN1 O00255 1/20 0.55
KLK7 P49862 8/20 0.54
KLK14 Q9P0G3 8/20 0.54
KLK5 Q9Y337 8/20 0.54
CTSG P08311 6/20 0.54
HSD17B10 Q99714 2/20 0.54
MAPK1 P28482 1/20 0.54
ALDH1A1 P00352 3/20 0.52
CTRC Q99895 2/20 0.52
HPGD P15428 2/20 0.52
MAPT P10636 1/20 0.52
PTK2B Q14289 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.47
KDM4E B2RXH2 4/20 0.46
POLB P06746 1/20 0.46
C1R P00736 1/20 0.46
ELANE P08246 3/20 0.45
NPC1 O15118 1/20 0.45
HTT P42858 1/20 0.44

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
SCHEMBL27632487 0.90 KMT2A (0.56) KMT2AMEN1KLK7KLK14KLK5
SCHEMBL22952908 0.75 KLK7 (0.67) KMT2AMEN1KLK7KLK14KLK5
SCHEMBL8499615 0.74 KMT2A (0.70) KMT2AMEN1KLK7KLK14KLK5
SCHEMBL18196637 0.73 KMT2A (0.61) KMT2AMEN1KLK7KLK14KLK5
SCHEMBL4202365 0.72 MEN1 (0.75) KMT2AMEN1KLK7KLK14KLK5
SCHEMBL4722006 0.71 MAPK1 (0.57) KMT2AMEN1HSD17B10MAPK1ALDH1A1
SCHEMBL12360752 0.71 HSD17B10 (0.72) KMT2AMEN1KLK7KLK14KLK5
SCHEMBL915918 0.71 NPC1 (0.56) KMT2AMEN1KLK7KLK14KLK5
SCHEMBL22272031 0.71 MEN1 (1.00) KMT2AMEN1KLK7KLK14KLK5
SCHEMBL23037197 0.71 MAPT (0.54) ALDH1A1MAPTSMN1; SMN2NPC1

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 KMT2A 2584/4885MEN1 1609/4885KLK7 590/4885

“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.