SCHEMBL1775488

SCHEMBL1775488

COC(=O)c1cccc(-n2ncc3c(N)cc(C)cc32)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 7/20 0.48
CCR1 P32246 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
TP53 P04637 1/20 0.45
GAA P10253 1/20 0.45
PMM2 O15305 1/20 0.44
MPI P34949 1/20 0.44
RAB9A P51151 1/20 0.44
PHOSPHO1 Q8TCT1 1/20 0.44
CYP11B2 P19099 2/20 0.43
ESRRA P11474 1/20 0.43
ALDH1A1 P00352 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
CYP2C19 P33261 1/20 0.42
CYP11B1 P15538 1/20 0.42

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
SCHEMBL9609077 0.91 NR3C1 (0.46) NR3C1CCR1MEN1KMT2ARXFP1
SCHEMBL303757 0.88 CCR1 (0.55) CCR1MEN1KMT2ARXFP1TP53
SCHEMBL13884763 0.88 NR3C1 (0.44) NR3C1CCR1MEN1KMT2ARXFP1
SCHEMBL1776385 0.87 MAPT (0.46) NR3C1MEN1KMT2ATP53GAA
SCHEMBL303719 0.84 TDP1 (0.45) NR3C1CCR1KMT2ARAB9AALDH1A1
SCHEMBL4401018 0.81 NPC1 (0.56) NR3C1KMT2ARXFP1TP53RAB9A
SCHEMBL9609001 0.80 NR3C1 (0.44) NR3C1CCR1MEN1KMT2ARXFP1
SCHEMBL304081 0.78 RAB9A (0.47) NR3C1MEN1KMT2ARAB9AALDH1A1
SCHEMBL304020 0.78 HTT (0.54) CCR1RXFP1ESRRAALDH1A1MAPT
SCHEMBL5007660 0.77 MEN1 (0.48) CCR1MEN1KMT2ARXFP1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2013185-B1 NOVEL COMPOUNDS GLAXO GROUP LTD (GB) 2012-05-30 EP disclosed
EP-2013185-B1 NOVEL COMPOUNDS GLAXO GROUP LTD (GB) 2012-05-30 EP disclosed
US-8178573-B2 Compounds GLAXO GROUP LIMITED (GB) 2012-05-15 US disclosed
US-8178573-B2 Compounds GLAXO GROUP LIMITED (GB) 2012-05-15 US disclosed
US-8178573-B2 Compounds GLAXO GROUP LIMITED (GB) 2012-05-15 US disclosed
US-7943651-B2 Compounds GLAXO GROUP LIMITED (GB) 2011-05-17 US disclosed
US-7943651-B2 Compounds GLAXO GROUP LIMITED (GB) 2011-05-17 US disclosed
US-7943651-B2 Compounds GLAXO GROUP LIMITED (GB) 2011-05-17 US disclosed
WO-2009074590-A1 N- (2 { [1-PHENYL-1H-INDAZ0L-4-YL] AMINO} PROPYL) -SULFONAMIDE DERIVATIVES AS NON-STEROIDAL GLUCOCORTICOID RECEPTOR LIGANDS FOR THE TREATMENT OF INFLAMMATIONS GLAXO GROUP LIMITED (GB) 2009-06-18 WO disclosed
WO-2009074590-A1 N- (2 { [1-PHENYL-1H-INDAZ0L-4-YL] AMINO} PROPYL) -SULFONAMIDE DERIVATIVES AS NON-STEROIDAL GLUCOCORTICOID RECEPTOR LIGANDS FOR THE TREATMENT OF INFLAMMATIONS GLAXO GROUP LIMITED (GB) 2009-06-18 WO disclosed
US-20090111866-A1 Novel Compounds GLAXO WELLCOME HOUSE (GB) 2009-04-30 US disclosed
US-20090111866-A1 Novel Compounds GLAXO WELLCOME HOUSE (GB) 2009-04-30 US disclosed
US-20090111866-A1 Novel Compounds GLAXO WELLCOME HOUSE (GB) 2009-04-30 US disclosed
US-20070265326-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2007-11-15 US disclosed
US-20070265326-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2007-11-15 US disclosed
US-20070265326-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2007-11-15 US disclosed
WO-2007122165-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2007-11-01 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 (2 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-20070265326-A1 NOVEL COMPOUNDS CCL11, MRGPRX2, LTB4R2 NR3C1 190/4885CCR1 70/4885MEN1 4193/4885
US-20090111866-A1 Novel Compounds CCL11, MRGPRX2, LTB4R2 NR3C1 190/4885CCR1 70/4885MEN1 4193/4885

“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.