SCHEMBL1648063

SCHEMBL1648063

Cc1cc(C)nc(N2CCCN(c3ccc(NC(=O)C(=O)c4c(C5CCCCC5)cc5ccccn45)cc3)CC2)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.38
RAB9A P51151 7/20 0.38
NPC1 O15118 5/20 0.38
L3MBTL1 Q9Y468 4/20 0.38
GAA P10253 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
PKM P14618 1/20 0.38
ALDH1A1 P00352 7/20 0.37
LMNA P02545 4/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 5/20 0.36
USP2 O75604 2/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
MAPK1 P28482 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
SLC2A1 P11166 2/20 0.35
BDKRB1 P46663 1/20 0.34
KDM4E B2RXH2 2/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL1645467 0.99 MAPT (0.37) MAPTRAB9ANPC1L3MBTL1GAA
SCHEMBL1645168 0.98 MAPT (0.38) MAPTRAB9ANPC1L3MBTL1GAA
SCHEMBL1646224 0.98 MAPT (0.38) MAPTRAB9ANPC1L3MBTL1GAA
SCHEMBL2232068 0.94 MAPT (0.39) MAPTRAB9ANPC1L3MBTL1GAA
SCHEMBL1647637 0.94 MAPT (0.40) MAPTRAB9ANPC1L3MBTL1GAA
SCHEMBL1646827 0.91 RAB9A (0.37) MAPTRAB9ANPC1L3MBTL1GAA
SCHEMBL1644920 0.91 MAPT (0.42) MAPTRAB9ANPC1GAAALDH1A1
SCHEMBL1644957 0.90 F13A1 (0.38) MAPTRAB9ANPC1L3MBTL1GAA
SCHEMBL1644918 0.89 F13A1 (0.39) MAPTRAB9ANPC1L3MBTL1ALDH1A1
SCHEMBL1645673 0.88 LMNA (0.38) MAPTRAB9ANPC1L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2097413-B1 2-[(2-SUBSTITUTED)-IND0LIZIN-3-YL]-2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS F2G LTD (GB) 2013-12-25 EP disclosed
US-8604029-B2 2-[(2-substituted)-indolizin-3-yl]-2-oxo-acetamide derivatives as antifungal agents F2G LTD BRITISH BODY CORPORATE (GB) 2013-12-10 US disclosed
US-20110183969-A1 ANTIFUNGAL COMBINATION THERAPY F2G LTD (GB) 2011-07-28 US disclosed
EP-2303329-A1 ANTIFUNGAL COMBINATION THERAPY F2G Limited (GB) 2011-04-06 EP disclosed
US-20100056511-A1 2- [ (2-SUBSTITUTED) -IND0LIZIN-3-YL] -2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS F2G LTD. 2010-03-04 US disclosed
WO-2009144473-A1 ANTIFUNGAL COMBINATION THERAPY F2G LIMITED (GB) 2009-12-03 WO disclosed
EP-2097413-A1 2-[(2-SUBSTITUTED)-IND0LIZIN-3-YL]-2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS F2G Limited (GB) 2009-09-09 EP disclosed
WO-2008062182-A1 2- [ (2-SUBSTITUTED) -IND0LIZIN-3-YL] -2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS F2G LTD (GB) 2008-05-29 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-20110183969-A1 ANTIFUNGAL COMBINATION THERAPY IDO1, FOXM1, IPO5 MAPT 1771/4885RAB9A 2410/4885NPC1 173/4885
US-20100056511-A1 2- [ (2-SUBSTITUTED) -IND0LIZIN-3-YL] -2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS NAT1, AGXT, CYP1A2 MAPT 2950/4885RAB9A 2787/4885NPC1 876/4885

“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.