SCHEMBL5146587

SCHEMBL5146587

O=C(O)c1cc(-c2ccc(C=C3NC(=O)N(Cc4ccc(F)cc4)C3=O)o2)ccc1Cl

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 11/20 0.74
KDM4E B2RXH2 10/20 0.74
MAPT P10636 10/20 0.74
ALDH1A1 P00352 10/20 0.74
POLB P06746 10/20 0.74
KMT2A Q03164 9/20 0.74
APEX1 P27695 8/20 0.74
L3MBTL1 Q9Y468 8/20 0.74
MEN1 O00255 7/20 0.74
RECQL P46063 6/20 0.74
LMNA P02545 1/20 0.74
PLA2G1B P04054 1/20 0.74
DNMT1 P26358 1/20 0.74
ATG4B Q9Y4P1 1/20 0.74
NPSR1 Q6W5P4 4/20 0.65
CTDSP1 Q9GZU7 4/20 0.64
PTPN1 P18031 1/20 0.64
APOBEC3A P31941 1/20 0.63
APOBEC3G Q9HC16 1/20 0.63
MCL1 Q07820 2/20 0.57

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
SCHEMBL6393879 1.00 TDP1 (0.74) TDP1KDM4EMAPTALDH1A1POLB
SCHEMBL6391161 0.86 TDP1 (0.83) TDP1KDM4EMAPTALDH1A1POLB
SCHEMBL6391164 0.86 TDP1 (0.83) TDP1KDM4EMAPTALDH1A1POLB
SCHEMBL6393742 0.84 TDP1 (0.79) TDP1KDM4EMAPTALDH1A1POLB
SCHEMBL6393226 0.84 TDP1 (0.79) TDP1KDM4EMAPTALDH1A1POLB
SCHEMBL46215 0.83 ENPP2 (0.75) TDP1KDM4EMAPTALDH1A1POLB
SCHEMBL29424240 0.81 MEN1 (0.85) TDP1MAPTALDH1A1POLBKMT2A
SCHEMBL5145183 0.80 TDP1 (0.75) TDP1KDM4EMAPTALDH1A1POLB
SCHEMBL5145178 0.80 TDP1 (0.75) TDP1KDM4EMAPTALDH1A1POLB
SCHEMBL21852274 0.77 KDM4E (0.85) TDP1KDM4EMAPTALDH1A1POLB

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
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-2005084141-A2 NOVEL ABIETANE DITERPENOID COMPOUND, AND COMPOSITION COMPRISING EXTRACT OF TORREYA NUCIFERA, OR ABIETANE DITERPENOID COMPOUNDS OR TERPENOID COMPOUNDS ISOLATED FROM THEM FOR PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASE KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2005-09-15 WO 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 TDP1 1996/4885KDM4E 4569/4885MAPT 2096/4885

“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.