SCHEMBL4575008

SCHEMBL4575008

CCOC(=O)C(=O)C(O)C1CCCC1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TSHR P16473 2/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
THRB P10828 1/20 0.39
ATM Q13315 1/20 0.39
PPM1B O75688 1/20 0.38
PTPN1 P18031 1/20 0.38
PPP1CC P36873 1/20 0.38
MAPT P10636 1/20 0.37
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL2256208 0.81 ALDH1A1 (0.53) ALDH1A1NPSR1TSHRL3MBTL1THRB
SCHEMBL5407976 0.79 ALDH1A1 (0.46) ALDH1A1NPSR1TSHRL3MBTL1THRB
SCHEMBL6336675 0.76 ALDH1A1 (0.36) ALDH1A1NPSR1TSHRL3MBTL1THRB
SCHEMBL165885 0.76 ALDH1A1 (0.49) ALDH1A1L3MBTL1THRBATMMAPT
SCHEMBL534242 0.75 CES2 (0.52) ALDH1A1L3MBTL1THRBATMMAPT
SCHEMBL7638404 0.75 CES2 (0.52) ALDH1A1L3MBTL1THRBATMMAPT
SCHEMBL7636018 0.75 CES2 (0.52) ALDH1A1L3MBTL1THRBATMMAPT
SCHEMBL12098093 0.74 ALDH1A1 (0.43) ALDH1A1NPSR1TSHRL3MBTL1THRB
SCHEMBL380982 0.74 L3MBTL1 (0.46) ALDH1A1NPSR1TSHRL3MBTL1PPM1B
SCHEMBL29998004 0.74 L3MBTL1 (0.46) ALDH1A1NPSR1TSHRL3MBTL1PPM1B

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-20080275032-A1 Pyridazinone compounds ANADYS PHARMACEUTICALS, INC. 2008-11-06 US disclosed
US-20080275032-A1 Pyridazinone compounds ANADYS PHARMACEUTICALS, INC. 2008-11-06 US disclosed
US-20080275032-A1 Pyridazinone compounds ANADYS PHARMACEUTICALS, INC. 2008-11-06 US disclosed
WO-2008082725-A1 PYRIDAZINONE COMPOUNDS ANADYS PHARMACEUTICALS, INC. (US) 2008-07-10 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 (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-20080275032-A1 Pyridazinone compounds HAVCR2, PLPBP, CYP3A43 ALDH1A1 1191/4885NPSR1 3482/4885TSHR 3163/4885

“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.