SCHEMBL1644873

SCHEMBL1644873

Cc1cc(C)nc(CNCCNc2ccc(NC(=O)C(=O)c3c(-c4ccccc4)cc4cccc(C)n34)cc2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
HTT P42858 3/20 0.37
MAPT P10636 6/20 0.36
ALDH1A1 P00352 3/20 0.36
THRB P10828 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ADRB1 P08588 1/20 0.34
ADRB3 P13945 1/20 0.34
VSIR Q9H7M9 1/20 0.32
KDM4E B2RXH2 3/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
HPGD P15428 1/20 0.32
CLK1 P49759 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
HDAC1 Q13547 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
PDCD1 Q15116 4/20 0.31

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
SCHEMBL1644976 0.88 LMNA (0.39) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL1647339 0.88 SMN1; SMN2 (0.50) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL1645530 0.85 LMNA (0.42) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL1646506 0.85 LMNA (0.41) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL1646302 0.84 HCRTR1 (0.38) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL1644875 0.83 LMNA (0.40) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL1646091 0.82 LMNA (0.38) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL1989977 0.82 CFTR (0.35) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL1988515 0.81 ADRB1 (0.33) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL1647760 0.80 SMN1; SMN2 (0.53) LMNASMN1; SMN2HTTMAPTALDH1A1

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 LMNA 3870/4885SMN1; SMN2 3682/4885HTT 1809/4885
US-20100056511-A1 2- [ (2-SUBSTITUTED) -IND0LIZIN-3-YL] -2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS NAT1, AGXT, CYP1A2 LMNA 1805/4885SMN1; SMN2 3079/4885HTT 3347/4885

“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.