SCHEMBL1865063

SCHEMBL1865063

O=C(NNC(=O)c1cccs1)Nc1ccc(Cl)cc1

nearest known ligand 0.75

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.75
NPC1 O15118 6/20 0.75
KMT2A Q03164 6/20 0.75
GAA P10253 5/20 0.75
MEN1 O00255 5/20 0.75
ALDH1A1 P00352 4/20 0.75
TDP1 Q9NUW8 3/20 0.75
LMNA P02545 2/20 0.75
MAPT P10636 2/20 0.75
HTT P42858 1/20 0.75
KDM4E B2RXH2 1/20 0.60
POLB P06746 1/20 0.60
SMN1; SMN2 Q16637 4/20 0.58
APOBEC3A P31941 1/20 0.58
APOBEC3G Q9HC16 1/20 0.58
L3MBTL1 Q9Y468 2/20 0.55
TP53 P04637 1/20 0.55

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
SCHEMBL1867069 0.86 RAB9A (0.73) RAB9ANPC1KMT2AGAAMEN1
SCHEMBL1858799 0.85 RAB9A (0.75) RAB9ANPC1KMT2AGAAMEN1
SCHEMBL1867503 0.85 GAA (0.60) RAB9ANPC1KMT2AGAAMEN1
SCHEMBL16040896 0.83 GAA (1.00) RAB9ANPC1KMT2AGAAMEN1
SCHEMBL1867467 0.81 MAPT (0.55) RAB9ANPC1KMT2AGAAMEN1
SCHEMBL9053766 0.79 LMNA (0.66) RAB9ANPC1KMT2AGAAMEN1
SCHEMBL1872034 0.79 POLB (0.65) RAB9ANPC1KMT2AGAAMEN1
SCHEMBL1858111 0.79 RAB9A (0.78) RAB9ANPC1KMT2AGAAMEN1
Hydrochloric Acid SCHEMBL7134294 0.78 LMNA (0.64) RAB9ANPC1KMT2AGAAMEN1
SCHEMBL1346796 0.75 POLB (0.54) RAB9ANPC1KMT2AGAAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1478364-A2 SELECTIVE ANTIBACTERIAL AGENTS 4SC AG (DE) 2004-11-24 EP claimed
US-20040063765-A1 Modulation of pathogenicity 4 SC AG (DE) 2004-04-01 US claimed
WO-2003039549-A2 SELECTIVE ANTIBACTERIAL AGENTS 4SC AG (DE) 2003-05-15 WO claimed
US-20110105597-A1 Modulation of pathogenicity QUONOVA, LLC 2011-05-05 US disclosed
US-20100280036-A1 Modulation of Pathogenicity QUONOVA, LLC 2010-11-04 US disclosed
US-20090076012-A1 Modulation of pathogenicity QUONOVA, LLC 2009-03-19 US disclosed
US-20080214635-A1 Modulation of pathogenicity QUONOVA, LLC 2008-09-04 US disclosed
US-20080194588-A1 Modulation of pathogcnicity QUONOVA, LLC 2008-08-14 US disclosed
US-20080194607-A1 Modulation of pathogenicity QUONOVA, LLC 2008-08-14 US disclosed
US-20080188536-A1 Modulation of pathogenicity QUONOVA, LLC 2008-08-07 US disclosed
US-20080188491-A1 Modulation of pathogenicity QUONOVA, LLC 2008-08-07 US disclosed
US-20080188535-A1 Modulation of pathogenicity QUONOVA, LLC 2008-08-07 US disclosed
US-20080182878-A1 Modulation of pathogenicity QUONOVA, LLC 2008-07-31 US disclosed
US-20080176938-A1 Modulation of pathogenicity QUONOVA, LLC 2008-07-24 US disclosed
US-7335779-B2 Modulation of pathogenicity QUONOVA, LLC (US) 2008-02-26 US disclosed
EP-1478364-A2 SELECTIVE ANTIBACTERIAL AGENTS 4SC AG (DE) 2004-11-24 EP disclosed
US-20040063765-A1 Modulation of pathogenicity 4 SC AG (DE) 2004-04-01 US disclosed
WO-2003039549-A2 SELECTIVE ANTIBACTERIAL AGENTS 4SC AG (DE) 2003-05-15 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 (12 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-20080194588-A1 Modulation of pathogcnicity NR4A1, NR4A2, NR3C2 RAB9A 4557/4885NPC1 1607/4885KMT2A 3684/4885
US-20090076012-A1 Modulation of pathogenicity NR4A1, NR4A2, NR4A3 RAB9A 4031/4885NPC1 512/4885KMT2A 3562/4885
US-20110105597-A1 Modulation of pathogenicity NR4A1, NR4A2, NR4A3 RAB9A 4032/4885NPC1 503/4885KMT2A 3588/4885
US-20080214635-A1 Modulation of pathogenicity NR4A1, NR4A2, NR4A3 RAB9A 4032/4885NPC1 503/4885KMT2A 3588/4885
US-20100280036-A1 Modulation of Pathogenicity NR4A1, NR4A2, NR4A3 RAB9A 4032/4885NPC1 503/4885KMT2A 3588/4885
US-20080182878-A1 Modulation of pathogenicity NR4A1, NR4A2, MSR1 RAB9A 4013/4885NPC1 493/4885KMT2A 3589/4885
US-20080188491-A1 Modulation of pathogenicity NR4A1, MSR1, NR4A2 RAB9A 4064/4885NPC1 507/4885KMT2A 3525/4885
US-20080194607-A1 Modulation of pathogenicity NR4A1, NR4A2, NR4A3 RAB9A 4032/4885NPC1 503/4885KMT2A 3588/4885
US-20080188535-A1 Modulation of pathogenicity NR4A1, NR4A2, NR4A3 RAB9A 4032/4885NPC1 503/4885KMT2A 3588/4885
US-20080188536-A1 Modulation of pathogenicity NR4A1, NR4A2, NR4A3 RAB9A 4032/4885NPC1 503/4885KMT2A 3588/4885
US-20080176938-A1 Modulation of pathogenicity NR4A1, NR4A2, NR4A3 RAB9A 3999/4885NPC1 390/4885KMT2A 3597/4885
US-20040063765-A1 Modulation of pathogenicity NR1H4, NR4A1, MSR1 RAB9A 3056/4885NPC1 143/4885KMT2A 3617/4885

“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.