SCHEMBL5146767

SCHEMBL5146767

CCN1C(=O)S/C(=C\c2ccc(-c3ccc(C(=O)O)cc3)o2)C1=O

nearest known ligand 0.80

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 1/20 0.80
ENPP2 Q13822 1/20 0.71
PSMB8 P28062 7/20 0.65
ITGB2 P05107 2/20 0.62
ITGAM P11215 2/20 0.62
NPC1 O15118 3/20 0.60
POLB P06746 3/20 0.60
RAB9A P51151 3/20 0.60
L3MBTL1 Q9Y468 3/20 0.60
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
ALDH1A1 P00352 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
GPR55 Q9Y2T6 1/20 0.59
SLC1A3 P43003 1/20 0.59
PTPN22 Q9Y2R2 2/20 0.58
CDK2 P24941 1/20 0.58
TDP1 Q9NUW8 1/20 0.56

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
SCHEMBL5146772 1.00 STAT3 (0.80) STAT3ENPP2PSMB8ITGB2ITGAM
SCHEMBL1430728 0.89 STAT3 (1.00) STAT3ENPP2PSMB8MEN1KMT2A
SCHEMBL16496688 0.89 STAT3 (1.00) STAT3ENPP2PSMB8MEN1KMT2A
SCHEMBL17088410 0.87 ITGB2 (0.71) STAT3ENPP2PSMB8ITGB2ITGAM
SCHEMBL12177763 0.87 ENPP2 (0.69) STAT3ENPP2PSMB8ITGB2ITGAM
SCHEMBL46552 0.86 PTPN22 (0.75) STAT3ENPP2PSMB8ITGB2ITGAM
SCHEMBL5144867 0.86 PTPN22 (0.75) STAT3ENPP2PSMB8ITGB2ITGAM
SCHEMBL684272 0.86 ENPP2 (0.83) STAT3ENPP2PSMB8ITGB2ITGAM
SCHEMBL16687571 0.86 ENPP2 (0.82) STAT3ENPP2PSMB8ITGB2ITGAM
SCHEMBL684546 0.83 ENPP2 (1.00) STAT3ENPP2PSMB8NPC1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1718308-A4 METHODS OF MODULATING NEUROTROPHIN-MEDIATED ACTIVITY PAINCEPTOR PHARMA CORP (CA) 2007-07-18 EP disclosed
EP-1718308-A2 METHODS OF MODULATING NEUROTROPHIN-MEDIATED ACTIVITY PainCeptor Pharma Corp. (CA) 2006-11-08 EP disclosed
US-20050282840-A1 Methods of modulating neurotrophin-mediated activity PAINCEPTOR PHARMA CORPORATION (CA) 2005-12-22 US disclosed
WO-2005076695-A2 METHODS OF MODULATING NEUROTROPHIN-MEDIATED ACTIVITY PAINCEPTOR PHARMA CORPORATION (CA) 2005-08-25 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-20050282840-A1 Methods of modulating neurotrophin-mediated activity NGF, BDNF, NTRK2 STAT3 1399/4885ENPP2 411/4885PSMB8 3663/4885

“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.