SCHEMBL5759836

SCHEMBL5759836

O=c1c2cc(Cl)ccc2nc(-c2ccc(-c3ccccc3)cc2)n1-c1ccc(Cl)cc1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.64
LMNA P02545 1/20 0.64
HTT P42858 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
MEN1 O00255 4/20 0.60
KMT2A Q03164 4/20 0.60
MAPT P10636 2/20 0.60
HSP90AA1 P07900 1/20 0.60
ALDH1A1 P00352 4/20 0.53
EGFR P00533 3/20 0.52
NPC1 O15118 1/20 0.52
ESR1 P03372 1/20 0.51
GAA P10253 1/20 0.51
KDR P35968 1/20 0.50
RAB9A P51151 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50

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
SCHEMBL5758700 0.97 KDM4E (0.67) KDM4ELMNAHTTL3MBTL1MEN1
SCHEMBL17642998 0.85 MEN1 (0.68) LMNAHTTMEN1KMT2AMAPT
SCHEMBL5807064 0.83 KDM4E (0.58) KDM4ELMNAHTTL3MBTL1MEN1
SCHEMBL5755184 0.81 MEN1 (0.46) KDM4ELMNAHTTL3MBTL1MEN1
SCHEMBL2566654 0.80 MAPT (0.62) KDM4EMEN1KMT2AMAPTHSP90AA1
SCHEMBL17643000 0.80 MEN1 (0.60) KDM4ELMNAHTTMEN1KMT2A
SCHEMBL5791751 0.78 MEN1 (0.56) KDM4ELMNAHTTMEN1KMT2A
SCHEMBL31276870 0.78 KDM4E (0.70) KDM4ELMNAHTTL3MBTL1MEN1
SCHEMBL15302024 0.78 NPC1 (0.70) KDM4ELMNAHTTL3MBTL1MAPT
SCHEMBL7437621 0.78 KMT2A (0.62) KDM4EHTTMEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1553947-A4 QUINAZOLINONES AND DERIVATIVES THEREOF AS FACTOR XA INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2006-11-29 EP claimed
EP-1553947-A2 QUINAZOLINONES AND DERIVATIVES THEREOF AS FACTOR XA INHIBITORS Bristol-Myers Squibb Company (US) 2005-07-20 EP claimed
US-20040132732-A1 Quinazolinones and derivatives thereof as factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY 2004-07-08 US claimed
WO-2004037176-A2 QUINAZOLINONES AND DERIVATIVES THEREOF AS FACTOR XA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-05-06 WO claimed
EP-1553947-A4 QUINAZOLINONES AND DERIVATIVES THEREOF AS FACTOR XA INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2006-11-29 EP disclosed
EP-1553947-A2 QUINAZOLINONES AND DERIVATIVES THEREOF AS FACTOR XA INHIBITORS Bristol-Myers Squibb Company (US) 2005-07-20 EP disclosed
US-20040132732-A1 Quinazolinones and derivatives thereof as factor Xa inhibitors BRISTOL-MYERS SQUIBB COMPANY 2004-07-08 US disclosed
WO-2004037176-A2 QUINAZOLINONES AND DERIVATIVES THEREOF AS FACTOR XA INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2004-05-06 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-20040132732-A1 Quinazolinones and derivatives thereof as factor Xa inhibitors F12, TFPI, SERPINC1 KDM4E 2809/4885LMNA 892/4885HTT 3714/4885

“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.