SCHEMBL5159753

SCHEMBL5159753

CC(=O)Nc1cc2c3c(cccc3c1)C(=O)N(c1cc(C(=O)O)ccc1Cl)C2=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
KLK7 P49862 1/20 0.51
CLTC Q00610 3/20 0.48
L3MBTL1 Q9Y468 2/20 0.46
CA12 O43570 1/20 0.46
CA9 Q16790 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
MEN1 O00255 5/20 0.44
KMT2A Q03164 5/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 3/20 0.43
CASP6 P55212 1/20 0.43
TLR9 Q9NR96 1/20 0.43
TYMS P04818 1/20 0.42
FTO Q9C0B1 1/20 0.40
MAPT P10636 1/20 0.40
USP2 O75604 1/20 0.39
BLM P54132 1/20 0.39

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
SCHEMBL5166807 0.93 CYP2C9 (0.44) CYP2C9CYP2C19KLK7CLTCL3MBTL1
SCHEMBL5160278 0.88 CYP2C9 (0.55) CYP2C9CYP2C19KLK7CLTCL3MBTL1
SCHEMBL5533685 0.87 CYP2C9 (0.54) CYP2C9CYP2C19KLK7CLTCL3MBTL1
SCHEMBL5163261 0.86 CYP2C19 (0.49) CYP2C9CYP2C19CLTCL3MBTL1CA12
SCHEMBL5148383 0.83 KLK7 (0.55) CYP2C9CYP2C19KLK7L3MBTL1CA12
SCHEMBL5163766 0.82 CYP2C9 (0.57) CYP2C9CYP2C19CLTCL3MBTL1CA12
SCHEMBL5159734 0.81 CYP2C9 (0.57) CYP2C9CYP2C19CLTCL3MBTL1CA12
SCHEMBL5533325 0.79 CYP2C9 (0.54) CYP2C9CYP2C19CLTCL3MBTL1CA12
SCHEMBL5158664 0.78 CLTC (0.76) CYP2C9CYP2C19CLTCL3MBTL1CA12
SCHEMBL5159288 0.77 MEN1 (0.60) KLK7L3MBTL1CA12CA9RXFP1

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-20070123514-A1 Methods of modulating neurotrophin-mediated activity PAINCEPTOR PHARMA CORPORATION (CA) 2007-05-31 US claimed
WO-2007030939-A2 METHODS OF MODULATING NEUROTROPHIN-MEDIATED ACTIVITY PAINCEPTOR PHARMA CORPORATION (CA) 2007-03-22 WO claimed
US-20070123514-A1 Methods of modulating neurotrophin-mediated activity PAINCEPTOR PHARMA CORPORATION (CA) 2007-05-31 US disclosed
US-20070123514-A1 Methods of modulating neurotrophin-mediated activity PAINCEPTOR PHARMA CORPORATION (CA) 2007-05-31 US disclosed
WO-2007030939-A2 METHODS OF MODULATING NEUROTROPHIN-MEDIATED ACTIVITY PAINCEPTOR PHARMA CORPORATION (CA) 2007-03-22 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-20070123514-A1 Methods of modulating neurotrophin-mediated activity NGF, BDNF, NTRK2 CYP2C9 4879/4885CYP2C19 4871/4885KLK7 2172/4885

“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.