SCHEMBL4600650

SCHEMBL4600650

O=C=Nc1ccc(-c2nc3ccccc3s2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.58
NPC1 O15118 7/20 0.58
APP P05067 5/20 0.58
KDM4E B2RXH2 4/20 0.58
MMP9 P14780 3/20 0.58
MMP8 P22894 3/20 0.58
MAPT P10636 3/20 0.58
GLA P06280 2/20 0.58
GAA P10253 2/20 0.58
ALDH1A1 P00352 2/20 0.58
LMNA P02545 1/20 0.58
MMP2 P08253 2/20 0.55
MMP13 P45452 2/20 0.55
SMN1; SMN2 Q16637 3/20 0.54
KMT2A Q03164 3/20 0.54
PKM P14618 2/20 0.54
MEN1 O00255 2/20 0.54
PAX8 Q06710 1/20 0.54
NOD2 Q9HC29 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54

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
SCHEMBL7256309 0.82 RAB9A (0.67) RAB9ANPC1APPKDM4EMMP9
SCHEMBL7256306 0.82 RAB9A (0.67) RAB9ANPC1APPKDM4EMMP9
SCHEMBL366824 0.82 RAB9A (0.81) RAB9ANPC1APPKDM4EMMP9
SCHEMBL29474819 0.82 RAB9A (0.81) RAB9ANPC1APPKDM4EMMP9
SCHEMBL592010 0.80 MAPT (0.62) RAB9ANPC1APPKDM4EMAPT
SCHEMBL24295138 0.80 RAB9A (0.79) RAB9ANPC1APPKDM4EMMP9
SCHEMBL19469420 0.80 RAB9A (0.63) RAB9ANPC1APPKDM4EMMP9
SCHEMBL11203721 0.80 RAB9A (0.63) RAB9ANPC1APPKDM4EMMP9
SCHEMBL3432884 0.80 RAB9A (0.63) RAB9ANPC1APPKDM4EMMP9
SCHEMBL9640671 0.80 RAB9A (0.63) RAB9ANPC1APPKDM4EMMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080171783-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROLIFERATIVE DISEASE MIGENIX INC. (CA) 2008-07-17 US disclosed
WO-2008080223-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROLIFERATIVE DISEASE MIGENIX INC. (CA) 2008-07-10 WO disclosed
EP-1910279-A2 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF MIGENIX INC. (CA) 2008-04-16 EP disclosed
US-20070021434-A1 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF MIGENIX INC. (CA) 2007-01-25 US disclosed
WO-2007002639-A2 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF MIGENIX INC. (CA) 2007-01-04 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-20070021434-A1 NON-NUCLEOSIDE ANTI-HEPACIVIRUS AGENTS AND USES THEREOF HAVCR2, ADAR, NSUN2 RAB9A 649/4885NPC1 83/4885APP 4824/4885
US-20080171783-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROLIFERATIVE DISEASE POLQ, POLI, POLH RAB9A 2724/4885NPC1 2526/4885APP 3824/4885

“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.