SCHEMBL1645632

SCHEMBL1645632

Fc1ccccc1-c1cc2ccccn2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.51
MAPT P10636 3/20 0.51
NPC1 O15118 2/20 0.51
POLB P06746 2/20 0.51
RAB9A P51151 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
KDM4E B2RXH2 1/20 0.51
L3MBTL1 Q9Y468 2/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
HRH3 Q9Y5N1 4/20 0.46
ALOX15 P16050 1/20 0.39
PTPRC P08575 1/20 0.39
PTPN1 P18031 1/20 0.39
GRM5 P41594 2/20 0.35
ACMSD Q8TDX5 1/20 0.35
BACE1 P56817 1/20 0.34
TRPA1 O75762 1/20 0.34
MAP4K4 O95819 2/20 0.34
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL29753975 1.00 ALDH1A1 (0.51) ALDH1A1MAPTNPC1POLBRAB9A
SCHEMBL3896087 0.85 ALDH1A1 (0.47) ALDH1A1MAPTNPC1POLBRAB9A
SCHEMBL3886932 0.79 ALDH1A1 (0.51) ALDH1A1MAPTNPC1POLBRAB9A
SCHEMBL1646529 0.79 ALDH1A1 (0.51) ALDH1A1MAPTNPC1POLBRAB9A
SCHEMBL30088582 0.79 ALDH1A1 (0.51) ALDH1A1MAPTNPC1POLBRAB9A
SCHEMBL17620577 0.79 ALDH1A1 (0.51) ALDH1A1MAPTNPC1POLBRAB9A
SCHEMBL1849443 0.79 ALDH1A1 (0.51) ALDH1A1MAPTNPC1POLBRAB9A
SCHEMBL3894978 0.76 ALDH1A1 (0.62) ALDH1A1MAPTNPC1POLBRAB9A
SCHEMBL3891998 0.76 HRH3 (0.53) ALDH1A1MAPTNPC1POLBRAB9A
SCHEMBL1645721 0.76 NPC1 (0.45) ALDH1A1MAPTNPC1POLBRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115537853-A Direct electrochemical synthesis method of triarylamine compound 浙江工业大学 2022-12-30 CN disclosed
CN-113582989-B Preparation method of cyanized or thiocyanized indolizine and derivatives thereof 广东药科大学 2022-07-08 CN disclosed
CN-113582989-A Preparation method of cyanized or thiocyanized indolizine and derivatives thereof 广东药科大学 2021-11-02 CN disclosed
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 ALDH1A1 2813/4885MAPT 1771/4885NPC1 173/4885
US-20100056511-A1 2- [ (2-SUBSTITUTED) -IND0LIZIN-3-YL] -2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS NAT1, AGXT, CYP1A2 ALDH1A1 318/4885MAPT 2950/4885NPC1 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.