SCHEMBL1646592

SCHEMBL1646592

COc1ccc2cc(-c3ccccc3)c(C(=O)C(=O)Nc3ccc(N4CCN(c5cc(C)ccn5)CC4)cc3)n2c1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 1/20 0.42
MAPK10 P53779 4/20 0.42
GFER P55789 1/20 0.42
DRD4 P21917 2/20 0.41
LMNA P02545 4/20 0.41
ALDH1A1 P00352 3/20 0.41
MAPT P10636 2/20 0.41
HTT P42858 2/20 0.41
USP2 O75604 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
GAA P10253 1/20 0.38
TSHR P16473 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
TP53 P04637 1/20 0.37

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
SCHEMBL1646568 0.91 LMNA (0.47) SLC1A2MAPK10LMNAALDH1A1MAPT
SCHEMBL1644569 0.91 MAPT (0.43) MAPK10DRD4LMNAALDH1A1MAPT
SCHEMBL2230718 0.89 LMNA (0.44) SLC1A2GFERDRD4LMNAALDH1A1
SCHEMBL2230725 0.89 ALDH1A1 (0.42) MAPK10DRD4LMNAALDH1A1MAPT
SCHEMBL2231057 0.89 ALDH1A1 (0.43) MAPK10DRD4LMNAALDH1A1MAPT
SCHEMBL1647365 0.87 LMNA (0.43) SLC1A2GFERDRD4LMNAALDH1A1
SCHEMBL1647296 0.87 ALDH1A1 (0.53) DRD4LMNAALDH1A1MAPTHTT
SCHEMBL1646567 0.87 SLC1A2 (0.43) SLC1A2GFERDRD4LMNAALDH1A1
SCHEMBL2230684 0.86 ALDH1A1 (0.46) DRD4LMNAALDH1A1MAPTHTT
SCHEMBL1647616 0.85 MAPT (0.51) DRD4LMNAALDH1A1MAPTHTT

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 SLC1A2 724/4885MAPK10 3944/4885GFER 3245/4885
US-20100056511-A1 2- [ (2-SUBSTITUTED) -IND0LIZIN-3-YL] -2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS NAT1, AGXT, CYP1A2 SLC1A2 1420/4885MAPK10 2780/4885GFER 1317/4885

“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.