SCHEMBL3279549

SCHEMBL3279549

Cc1ccccc1C(=O)Nc1sc2c(c1C#N)CCCC2

nearest known ligand 0.80

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.80
KMT2A Q03164 6/20 0.80
ALDH1A1 P00352 5/20 0.80
LMNA P02545 1/20 0.80
MAPK10 P53779 6/20 0.77
MAPK9 P45984 1/20 0.74
NPC1 O15118 5/20 0.72
HPGD P15428 4/20 0.71
RAB9A P51151 4/20 0.71
SMN1; SMN2 Q16637 4/20 0.71
KDM4E B2RXH2 3/20 0.71
THRB P10828 1/20 0.71
FLT3 P36888 1/20 0.66
SENP7 Q9BQF6 1/20 0.65
GAA P10253 1/20 0.63
SORT1 Q99523 1/20 0.62
HTT P42858 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62

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
SCHEMBL15281390 0.88 MAPK10 (0.77) MEN1KMT2AALDH1A1LMNAMAPK10
SCHEMBL23200418 0.87 MAPK10 (0.76) MEN1KMT2AALDH1A1LMNAMAPK10
SCHEMBL3277942 0.87 MAPK10 (0.76) MEN1KMT2AALDH1A1LMNAMAPK10
Gw572738X SCHEMBL3284953 0.87 MAPK10 (1.00) MEN1KMT2AALDH1A1LMNAMAPK10
SCHEMBL3278507 0.87 MAPK10 (1.00) MEN1KMT2AALDH1A1LMNAMAPK10
SCHEMBL3284934 0.86 KMT2A (0.96) MEN1KMT2AALDH1A1LMNAMAPK10
Gw620972X SCHEMBL29404766 0.85 MAPK10 (1.00) MEN1KMT2AALDH1A1LMNAMAPK10
Gw620972X SCHEMBL157875 0.85 MAPK10 (1.00) MEN1KMT2AALDH1A1LMNAMAPK10
SCHEMBL23200287 0.85 MAPK10 (0.72) MEN1KMT2AALDH1A1LMNAMAPK10
SCHEMBL31074969 0.84 MAPK10 (0.98) MEN1KMT2AALDH1A1LMNAMAPK10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7700615-B2 Cell migration inhibiting compositions and methods and compositions for treating cancer AVOLIX PHARMACEUTICALS, INC. (US) 2010-04-20 US disclosed
EP-1576110-A4 CELL MIGRATION INHIBITING COMPOSITIONS AND METHODS AND COMPOSITIONS FOR TREATING CANCER AVOLIX PHARMACEUTICALS (US) 2007-11-07 EP disclosed
US-20060128742-A1 Cell migration inhibiting compositions and methods and compositions for treating cancer AVOLIX PHARMACEUTICALS, INC. 2006-06-15 US disclosed
US-7012100-B1 Cell migration inhibiting compositions and methods and compositions for treating cancer AVOLIX PHARMACEUTICALS, INC. (US) 2006-03-14 US disclosed
EP-1576110-A2 CELL MIGRATION INHIBITING COMPOSITIONS AND METHODS AND COMPOSITIONS FOR TREATING CANCER Avolix Pharmaceuticals (US) 2005-09-21 EP disclosed
WO-2003102153-A2 CELL MIGRATION INHIBITING COMPOSITIONS AND METHODS AND COMPOSITIONS FOR TREATING CANCER AVOLIX PHARMACEUTICALS (US) 2003-12-11 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-20060128742-A1 Cell migration inhibiting compositions and methods and compositions for treating cancer MKI67, DCX, NUDC MEN1 1184/4885KMT2A 4115/4885ALDH1A1 1944/4885

“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.