SCHEMBL5467200

SCHEMBL5467200

O=C(c1ccc(Cl)c(-n2c(=O)[nH]c3ccccc3c2=O)c1)N1CCCCCC1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.64
LMNA P02545 5/20 0.64
HPGD P15428 4/20 0.64
HSD17B10 Q99714 4/20 0.64
GAA P10253 3/20 0.64
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
GLA P06280 1/20 0.64
SMN1; SMN2 Q16637 8/20 0.53
HTT P42858 4/20 0.53
KDM4E B2RXH2 2/20 0.52
TP53 P04637 1/20 0.50
AURKA O14965 1/20 0.48
USP2 O75604 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MAPT P10636 3/20 0.47
PKM P14618 1/20 0.47
MAPK1 P28482 1/20 0.47
NPBWR1 P48145 1/20 0.46
MCHR1 Q99705 1/20 0.46

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
SCHEMBL5467235 0.90 PKM (0.52) ALDH1A1LMNAHPGDHSD17B10GAA
SCHEMBL14597113 0.85 LMNA (0.47) ALDH1A1LMNAHPGDHSD17B10GAA
SCHEMBL5470732 0.85 ALDH1A1 (0.53) ALDH1A1LMNAHPGDHSD17B10GAA
SCHEMBL5470741 0.85 CNR2 (0.53) ALDH1A1LMNAHPGDHSD17B10GAA
SCHEMBL5472658 0.84 MEN1 (0.56) ALDH1A1LMNAHPGDHSD17B10GAA
SCHEMBL5470611 0.83 KDM4E (0.60) ALDH1A1HPGDHSD17B10GAAMEN1
SCHEMBL5461017 0.82 KMT2A (0.54) ALDH1A1LMNAHPGDHSD17B10GAA
SCHEMBL5464451 0.82 ALDH1A1 (0.53) ALDH1A1LMNAHPGDGAAMEN1
Trifluoroacetic Acid SCHEMBL5469149 0.82 RAB9A (0.53) ALDH1A1LMNAHPGDHSD17B10GAA
SCHEMBL5467091 0.81 KDM4E (0.46) ALDH1A1LMNAHPGDHSD17B10GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070010537-A1 Fused pyramidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-01-11 US disclosed
US-20070010537-A1 Fused pyramidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-01-11 US disclosed
US-20070010537-A1 Fused pyramidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-01-11 US disclosed
EP-1657238-A1 FUSED PYRIMIDINE DERIVATIVE AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2006-05-17 EP 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 (1 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-20070010537-A1 Fused pyramidine derivative and use thereof NR5A1, GNRHR, RXFP3 ALDH1A1 1875/4885LMNA 2632/4885HPGD 375/4885

“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.