SCHEMBL5445324

SCHEMBL5445324

COc1ccc(SCc2cc(C(=O)O)no2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.55
MAPT P10636 3/20 0.55
HPGD P15428 3/20 0.55
RECQL P46063 1/20 0.55
GAA P10253 1/20 0.47
LMNA P02545 3/20 0.44
TDP1 Q9NUW8 2/20 0.43
HTT P42858 1/20 0.43
PPARD Q03181 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
DAO P14920 1/20 0.42
MTNR1A P48039 1/20 0.42
MTNR1B P49286 1/20 0.42
CYP1A2 P05177 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
APP P05067 1/20 0.41
MEN1 O00255 1/20 0.41
CYP2C9 P11712 1/20 0.41

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
SCHEMBL5451857 0.86 ALDH1A1 (0.55) ALDH1A1MAPTHPGDRECQLLMNA
SCHEMBL14582444 0.86 ALDH1A1 (0.48) ALDH1A1MAPTHPGDGAALMNA
SCHEMBL5461144 0.85 MEN1 (0.54) ALDH1A1MAPTRECQLGAALMNA
SCHEMBL5458534 0.82 MEN1 (0.60) ALDH1A1MAPTHPGDGAALMNA
SCHEMBL5449783 0.82 DAO (0.48) ALDH1A1MAPTHPGDRECQLLMNA
SCHEMBL15931718 0.79 ALDH1A1 (0.58) ALDH1A1MAPTHPGDRECQLLMNA
SCHEMBL5445311 0.78 PPARD (0.53) LMNATDP1PPARDSMN1; SMN2NPC1
SCHEMBL15931685 0.76 MAPT (0.55) ALDH1A1MAPTHPGDRECQLTDP1
SCHEMBL5460248 0.73 L3MBTL1 (0.61) ALDH1A1MAPTGAALMNATDP1
SCHEMBL23132428 0.73 HCAR2 (0.49) ALDH1A1MAPTHPGDRECQLHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070043062-A1 Isoxazoles as peptide deformylase inhibitors ARPIDA A/S (DK) 2007-02-22 US claimed
EP-1664000-A1 ISOXAZOLES AS PEPTIDE DEFORMYLASE INHIBITORS Arpida A/S (DK) 2006-06-07 EP claimed
WO-2005026133-A1 ISOXAZOLES AS PEPTIDE DEFORMYLASE INHIBITORS ARPIDA A/S (DK) 2005-03-24 WO claimed
US-20070043062-A1 Isoxazoles as peptide deformylase inhibitors ARPIDA A/S (DK) 2007-02-22 US disclosed
US-20070043062-A1 Isoxazoles as peptide deformylase inhibitors ARPIDA A/S (DK) 2007-02-22 US disclosed
US-20070043062-A1 Isoxazoles as peptide deformylase inhibitors ARPIDA A/S (DK) 2007-02-22 US disclosed
EP-1664000-A1 ISOXAZOLES AS PEPTIDE DEFORMYLASE INHIBITORS Arpida A/S (DK) 2006-06-07 EP disclosed
WO-2005026133-A1 ISOXAZOLES AS PEPTIDE DEFORMYLASE INHIBITORS ARPIDA A/S (DK) 2005-03-24 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-20070043062-A1 Isoxazoles as peptide deformylase inhibitors PDF, MRPL21, PEPD ALDH1A1 1786/4885MAPT 4482/4885HPGD 724/4885

“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.