SCHEMBL1647299

SCHEMBL1647299

Cc1ccnc(N2CCN(c3ccc(NC(=O)C(=O)c4c(C5CCCC5)cc5ccccn45)cc3)CC2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.39
ALDH1A1 P00352 5/20 0.39
MAPT P10636 4/20 0.39
BDKRB1 P46663 1/20 0.38
CPT2 P23786 1/20 0.38
CPT1A P50416 1/20 0.38
CPT1B Q92523 1/20 0.38
HTT P42858 4/20 0.38
LMNA P02545 3/20 0.38
DRD2 P14416 1/20 0.38
DRD4 P21917 1/20 0.38
DRD3 P35462 1/20 0.38
PROKR1 Q8TCW9 2/20 0.37
RAB9A P51151 5/20 0.36
NPC1 O15118 3/20 0.36
NPSR1 Q6W5P4 2/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPK1 P28482 1/20 0.36

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
SCHEMBL2229594 0.99 BDKRB1 (0.39) KDM4EALDH1A1MAPTBDKRB1CPT2
SCHEMBL1644347 0.94 MAPT (0.42) KDM4EALDH1A1MAPTHTTLMNA
SCHEMBL1646577 0.90 BDKRB1 (0.45) KDM4EALDH1A1MAPTBDKRB1HTT
SCHEMBL2231498 0.90 DRD2 (0.42) KDM4EALDH1A1MAPTBDKRB1HTT
SCHEMBL1645466 0.89 BDKRB1 (0.46) KDM4EALDH1A1MAPTBDKRB1HTT
SCHEMBL2230946 0.89 DRD2 (0.42) KDM4EALDH1A1MAPTBDKRB1HTT
SCHEMBL1646224 0.89 MAPT (0.38) KDM4EALDH1A1MAPTBDKRB1HTT
SCHEMBL1645168 0.88 MAPT (0.38) KDM4EALDH1A1MAPTBDKRB1HTT
SCHEMBL1645467 0.87 MAPT (0.37) KDM4EALDH1A1MAPTHTTLMNA
SCHEMBL1648063 0.86 MAPT (0.38) KDM4EALDH1A1MAPTBDKRB1HTT

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-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
CN-101679410-B 2-[(2-substituted)-ind0lizin-3-yl]-2-oxo-acetamide derivatives as antifungal agents F2G LTD 2013-11-27 CN disclosed
US-20110183969-A1 ANTIFUNGAL COMBINATION THERAPY F2G LTD (GB) 2011-07-28 US disclosed
CN-102105170-A Antifungal combination therapy F2G LTD 2011-06-22 CN disclosed
EP-2303329-A1 ANTIFUNGAL COMBINATION THERAPY F2G Limited (GB) 2011-04-06 EP disclosed
CN-101679410-A 2-[(2-substituted)-ind0lizin-3-yl]-2-oxo-acetamide derivatives as antifungal agents F2G LTD 2010-03-24 CN 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 KDM4E 2593/4885ALDH1A1 2813/4885MAPT 1771/4885
US-20100056511-A1 2- [ (2-SUBSTITUTED) -IND0LIZIN-3-YL] -2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS NAT1, AGXT, CYP1A2 KDM4E 1543/4885ALDH1A1 318/4885MAPT 2950/4885

“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.