SCHEMBL6159464

SCHEMBL6159464

C#Cc1cccc(NCc2ccccc2OC)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
HIF1A Q16665 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.50
MAPT P10636 6/20 0.49
GAA P10253 5/20 0.47
ALDH1A1 P00352 8/20 0.46
MAPK1 P28482 3/20 0.46
TSHR P16473 2/20 0.46
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2C19 P33261 2/20 0.46
CLK4 Q9HAZ1 2/20 0.46
KDM4E B2RXH2 3/20 0.46
ALOX15 P16050 1/20 0.46
HTT P42858 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
HPGD P15428 1/20 0.46
KDM1A O60341 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL6159333 0.80 MAPT (0.52) MEN1KMT2AHIF1AL3MBTL1MAPT
SCHEMBL22624701 0.80 MAPT (0.50) MEN1KMT2AL3MBTL1MAPTGAA
SCHEMBL30287924 0.78 HIF1A (0.74) MEN1KMT2AHIF1AL3MBTL1MAPT
SCHEMBL10388545 0.78 HIF1A (0.74) MEN1KMT2AHIF1AL3MBTL1MAPT
SCHEMBL22624772 0.78 MAPT (0.61) MEN1KMT2AHIF1AMAPTGAA
SCHEMBL5612878 0.77 MAPT (0.44) MEN1KMT2AMAPTALDH1A1MAPK1
SCHEMBL22624720 0.76 LMNA (0.55) MEN1KMT2AHIF1AMAPTGAA
SCHEMBL22624793 0.74 KDM4E (0.45) L3MBTL1MAPTGAAKDM4EHPGD
SCHEMBL15576278 0.73 LMNA (0.54) MEN1KMT2AHIF1AL3MBTL1MAPT
SCHEMBL30358933 0.72 MEN1 (0.60) MEN1KMT2AHIF1AL3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1434772-A4 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORP (US) 2005-05-04 EP claimed
US-20040192914-A1 Compounds and methods SMITHKLINE BEECHAM CORPORATION 2004-09-30 US claimed
EP-1434772-A1 COMPOUNDS AND METHODS SmithKline Beecham Corporation (US) 2004-07-07 EP claimed
WO-2003031434-A1 COMPOUNDS AND METHODS SMITH KLINE BEECHAM CORPORATION (US) 2003-04-17 WO claimed
US-20050143578-A1 Compounds and methods SMITHKLINE BEECHAM CORPORATION 2005-06-30 US disclosed
EP-1434772-A4 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORP (US) 2005-05-04 EP disclosed
US-20040192914-A1 Compounds and methods SMITHKLINE BEECHAM CORPORATION 2004-09-30 US disclosed
EP-1434772-A1 COMPOUNDS AND METHODS SmithKline Beecham Corporation (US) 2004-07-07 EP disclosed
WO-2003031434-A1 COMPOUNDS AND METHODS SMITH KLINE BEECHAM CORPORATION (US) 2003-04-17 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 (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-20040192914-A1 Compounds and methods METAP2, METAP1, DNPEP MEN1 2227/4885KMT2A 1695/4885HIF1A 561/4885
US-20050143578-A1 Compounds and methods METAP2, METAP1, DNPEP MEN1 2661/4885KMT2A 1214/4885HIF1A 640/4885

“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.