SCHEMBL1645720

SCHEMBL1645720

Nc1ccc(N2CCN(CC3CCOCC3)CC2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.54
GFER P55789 4/20 0.54
KDM4E B2RXH2 3/20 0.54
GAA P10253 3/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
RAD52 P43351 1/20 0.54
ALDH1A1 P00352 3/20 0.46
HTT P42858 2/20 0.46
KMT2A Q03164 2/20 0.46
ADRA2C P18825 2/20 0.46
LMNA P02545 2/20 0.46
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
PTK2B Q14289 1/20 0.46
ESR2 Q92731 1/20 0.46
EBP Q15125 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.43
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
USP2 O75604 1/20 0.43

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
SCHEMBL5725238 0.90 MAPT (0.61) MAPTGFERKDM4EGAASMN1; SMN2
SCHEMBL29367 0.88 MAPT (0.46) MAPTGFERKDM4EGAASMN1; SMN2
SCHEMBL12005398 0.86 MAPT (0.56) MAPTGFERKDM4EGAASMN1; SMN2
SCHEMBL16848707 0.86 MAPT (0.56) MAPTGFERKDM4EGAASMN1; SMN2
SCHEMBL521039 0.80 MAPT (0.62) MAPTGFERKDM4EGAASMN1; SMN2
SCHEMBL1647766 0.80 KMT2A (0.56) MAPTALDH1A1KMT2ATDP1MEN1
SCHEMBL12073558 0.79 L3MBTL1 (0.58) MAPTGFERKDM4EGAASMN1; SMN2
SCHEMBL22542103 0.78 EBP (0.48) MAPTGAAKMT2AADRA2CEBP
SCHEMBL24452000 0.77 ALDH1A1 (0.45) MAPTKDM4EGAASMN1; SMN2ALDH1A1
SCHEMBL20076185 0.77 MAPT (0.45) MAPTGFERKDM4EGAASMN1; SMN2

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
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

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 1771/4885GFER 3245/4885KDM4E 2593/4885
US-20100056511-A1 2- [ (2-SUBSTITUTED) -IND0LIZIN-3-YL] -2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS NAT1, AGXT, CYP1A2 MAPT 2950/4885GFER 1317/4885KDM4E 1543/4885

“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.