SCHEMBL4207152

SCHEMBL4207152

COC(=O)c1cc(COS(C)(=O)=O)cc(OCc2ccccc2)c1

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.55
LMNA P02545 1/20 0.55
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
MRGPRX4 Q96LA9 2/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
MAOB P27338 2/20 0.47
AR P10275 2/20 0.47
NR4A2 P43354 1/20 0.46
SMPD1 P17405 1/20 0.45
ALDH1A1 P00352 2/20 0.45
PTPN1 P18031 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
SCHEMBL5373770 0.84 AR (0.55) HPGDMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL183994 0.84 LMNA (0.70) HPGDLMNAMEN1KMT2AMRGPRX4
SCHEMBL391547 0.84 MEN1 (0.71) HPGDLMNAMEN1KMT2AMRGPRX4
SCHEMBL3132629 0.83 LMNA (0.62) HPGDLMNAMEN1KMT2AMRGPRX4
SCHEMBL4402201 0.83 ALDH1A1 (0.44) HPGDMEN1KMT2ASMN1; SMN2NPC1
SCHEMBL31385500 0.83 MRGPRX4 (0.63) MRGPRX4MAOBNR4A2
SCHEMBL15163970 0.81 HPGD (0.56) HPGDLMNAMEN1KMT2AMRGPRX4
SCHEMBL17570969 0.81 CA1 (0.48) HPGDLMNASMN1; SMN2ALDH1A1
SCHEMBL3129603 0.80 MEN1 (0.74) HPGDLMNAMEN1KMT2AMRGPRX4
SCHEMBL29788280 0.80 LMNA (0.65) HPGDLMNAMEN1KMT2AMRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090118261-A1 QUINAZOLINONE DERIVATIVES AND THEIR USE AS B-RAF INHIBITORS ASTRAZENECA AB (SE) 2009-05-07 US disclosed
US-20080207616-A1 Quinoxalines as B Baf Inhhibitors ASTRAZENECA AB (SE) 2008-08-28 US disclosed
US-20070259849-A1 Azine-Carboxamides as Anti-Cancer Agents ASTRAZENECA AB (SE) 2007-11-08 US disclosed
EP-1828147-A1 QUINOXALINES AS B-RAF INHIBITORS AstraZeneca AB (SE) 2007-09-05 EP disclosed
EP-1789399-A1 QUINAZOLINONE DERIVATIVES AND THEIR USE AS B-RAF INHIBITORS AstraZeneca AB (SE) 2007-05-30 EP disclosed
WO-2006040568-A1 QUINOXALINES AS B RAF INHIBITORS ASTRAZENECA AB (SE) 2006-04-20 WO disclosed
WO-2006024834-A1 QUINAZOLINONE DERIVATIVES AND THEIR USE AS B-RAF INHIBITORS ASTRAZENECA AB (SE) 2006-03-09 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 (3 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-20090118261-A1 QUINAZOLINONE DERIVATIVES AND THEIR USE AS B-RAF INHIBITORS BRAF, RAF1, ARAF HPGD 1530/4885LMNA 2447/4885MEN1 1111/4885
US-20070259849-A1 Azine-Carboxamides as Anti-Cancer Agents ARAF, BRAF, RAF1 HPGD 3441/4885LMNA 4138/4885MEN1 486/4885
US-20080207616-A1 Quinoxalines as B Baf Inhhibitors BRAF, NRAS, ARAF HPGD 1324/4885LMNA 787/4885MEN1 671/4885

“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.