SCHEMBL5167537

SCHEMBL5167537

COC(=O)C(C)N1C(=O)S/C(=C/c2ccc(-c3ccc(C)c([N+](=O)[O-])c3)o2)C1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.62
KMT2A Q03164 5/20 0.62
RAB9A P51151 4/20 0.62
NPC1 O15118 3/20 0.62
POLB P06746 3/20 0.62
APOBEC3A P31941 1/20 0.62
APOBEC3G Q9HC16 1/20 0.62
SLC1A3 P43003 1/20 0.57
L3MBTL1 Q9Y468 3/20 0.52
TDP1 Q9NUW8 2/20 0.52
MAPT P10636 3/20 0.51
ALDH1A1 P00352 3/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
LMNA P02545 2/20 0.50
CTDSP1 Q9GZU7 2/20 0.50
RECQL P46063 1/20 0.50
MCL1 Q07820 1/20 0.50
GRK2 P25098 1/20 0.50
DNMT1 P26358 1/20 0.50
MYC P01106 1/20 0.48

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
SCHEMBL5167542 1.00 MEN1 (0.62) MEN1KMT2ARAB9ANPC1POLB
SCHEMBL6389833 0.80 MEN1 (0.70) MEN1KMT2ARAB9ANPC1POLB
SCHEMBL6389826 0.80 MEN1 (0.70) MEN1KMT2ARAB9ANPC1POLB
SCHEMBL5145169 0.78 KMT2A (0.88) MEN1KMT2ARAB9ANPC1POLB
SCHEMBL6395526 0.78 KMT2A (0.88) MEN1KMT2ARAB9ANPC1POLB
SCHEMBL5164957 0.75 PTPN22 (0.65) MAPTMAP3K5PTPN22
SCHEMBL5164951 0.75 PTPN22 (0.65) MAPTMAP3K5PTPN22
SCHEMBL46551 0.75 SLC1A3 (0.73) MEN1KMT2ARAB9ANPC1POLB
SCHEMBL1063265 0.73 MEN1 (0.67) MEN1KMT2APOLBTDP1MAPT
SCHEMBL1063266 0.73 MEN1 (0.67) MEN1KMT2APOLBTDP1MAPT

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 MEN1 4004/4885KMT2A 4410/4885RAB9A 3139/4885

“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.