SCHEMBL5132896

SCHEMBL5132896

O=C(O)c1cccc(N2C(=O)c3ccc4c5c(ccc(c35)C2=O)C(=O)OC4=O)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 8/20 0.64
MEN1 O00255 7/20 0.64
ALDH1A1 P00352 4/20 0.64
KDM4E B2RXH2 4/20 0.64
TYMS P04818 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.56
L3MBTL1 Q9Y468 5/20 0.55
POLB P06746 4/20 0.55
CASP6 P55212 3/20 0.55
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
RXFP1 Q9HBX9 3/20 0.54
MAPK1 P28482 1/20 0.54
S100B P04271 1/20 0.54
RECQL P46063 3/20 0.53
MAPT P10636 1/20 0.53
TDP1 Q9NUW8 3/20 0.52
HSD17B10 Q99714 2/20 0.51
CA12 O43570 1/20 0.50
CA9 Q16790 1/20 0.50

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
SCHEMBL14172750 0.93 KMT2A (0.72) KMT2AMEN1ALDH1A1KDM4ETYMS
SCHEMBL16602052 0.87 KMT2A (0.70) KMT2AMEN1ALDH1A1KDM4ETYMS
SCHEMBL14510327 0.86 KMT2A (0.64) KMT2AMEN1ALDH1A1KDM4ETYMS
SCHEMBL5160880 0.84 KMT2A (0.63) KMT2AMEN1ALDH1A1KDM4ETYMS
SCHEMBL5160901 0.84 KMT2A (0.63) KMT2AMEN1ALDH1A1KDM4ETYMS
SCHEMBL1514286 0.82 L3MBTL1 (0.73) KMT2AMEN1ALDH1A1KDM4ETYMS
SCHEMBL4230581 0.82 S100B (0.74) KMT2AMEN1ALDH1A1KDM4ETYMS
SCHEMBL7825377 0.82 TYMS (0.71) KMT2AMEN1ALDH1A1KDM4ETYMS
SCHEMBL29549557 0.82 TYMS (0.71) KMT2AMEN1ALDH1A1KDM4ETYMS
SCHEMBL18201564 0.81 NPC1 (0.69) KMT2AMEN1ALDH1A1KDM4ETYMS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1931664-A2 METHODS OF MODULATING NEUROTROPHIN-MEDIATED ACTIVITY PainCeptor Pharma Corp. (CA) 2008-06-18 EP claimed
US-7279580-B2 Imidazo-pyridine derivatives as ligands for GABA receptors MERCK SHARP & DOHME LIMITED (GB) 2007-10-09 US claimed
US-20070099900-A1 Methods of modulating neurotrophin-mediated activity PAINCEPTOR PHARMA CORPORATION (CA) 2007-05-03 US claimed
WO-2007030934-A2 METHODS OF MODULATING NEUROTROPHIN-MEDIATED ACTIVITY PAINCEPTOR PHARMA CORPORATION (CA) 2007-03-22 WO claimed
US-7279580-B2 Imidazo-pyridine derivatives as ligands for GABA receptors MERCK SHARP & DOHME LIMITED (GB) 2007-10-09 US disclosed
US-20070099900-A1 Methods of modulating neurotrophin-mediated activity PAINCEPTOR PHARMA CORPORATION (CA) 2007-05-03 US disclosed
US-20070099900-A1 Methods of modulating neurotrophin-mediated activity PAINCEPTOR PHARMA CORPORATION (CA) 2007-05-03 US disclosed
US-20070099900-A1 Methods of modulating neurotrophin-mediated activity PAINCEPTOR PHARMA CORPORATION (CA) 2007-05-03 US disclosed
WO-2007030934-A2 METHODS OF MODULATING NEUROTROPHIN-MEDIATED ACTIVITY PAINCEPTOR PHARMA CORPORATION (CA) 2007-03-22 WO disclosed
US-20050165048-A1 Imidazo-pyridine derivatives as ligands for gaba receptors MERCK SHARP & DOHME LTD. (GB) 2005-07-28 US 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-20070099900-A1 Methods of modulating neurotrophin-mediated activity NGF, BDNF, NTRK2 KMT2A 4267/4885MEN1 3865/4885ALDH1A1 2086/4885
US-20050165048-A1 Imidazo-pyridine derivatives as ligands for gaba receptors GABRA3, GABRA2, GABRA5 KMT2A 1066/4885MEN1 4452/4885ALDH1A1 995/4885

“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.