SCHEMBL4263531

SCHEMBL4263531

COc1ccccc1-c1nc2cc(Oc3c(Cl)cc(C(=O)NCC(=O)O)cc3Cl)ccc2[nH]1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.43
TP53 P04637 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
EGLN1 Q9GZT9 1/20 0.41
APLNR P35414 1/20 0.41
AMY1A P0DUB6 2/20 0.40
HDAC6 Q9UBN7 1/20 0.40
FOXO1 Q12778 1/20 0.40
ROCK2 O75116 1/20 0.39
ROCK1 Q13464 1/20 0.39
KLKB1 P03952 1/20 0.39
F7 P08709 1/20 0.39
SCD O00767 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
PKM P14618 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL4300846 0.81 MAPT (0.47) MAPTTP53SMN1; SMN2EGLN1
SCHEMBL3984716 0.80 EGLN1 (0.38) MAPTTP53SMN1; SMN2EGLN1SCD
SCHEMBL3980253 0.75 EGLN1 (0.40) EGLN1
SCHEMBL3990474 0.70 KDM4E (0.47) MAPTSMN1; SMN2EGLN1
SCHEMBL2786907 0.70 THRB (0.67)
SCHEMBL3981285 0.69 EGLN1 (0.38) EGLN1
SCHEMBL23758274 0.69 AMY1A (0.64) AMY1A
SCHEMBL2787214 0.69 THRA (0.71) SMN1; SMN2
SCHEMBL5619110 0.68 THRB (0.65)
SCHEMBL4347525 0.68 THRB (0.49)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009080835-A1 THYROMIMETRIC COMPOUNDS IN TREATMENT OF DISEASE RELATED TO SONIC HEDGEHOG SIGNALLING KARO BIO AB (SE) 2009-07-02 WO claimed
US-20090318514-A1 Novel Pharmaceutical Compositions KARO BIO AB (SE) 2009-12-24 US disclosed
WO-2009080835-A1 THYROMIMETRIC COMPOUNDS IN TREATMENT OF DISEASE RELATED TO SONIC HEDGEHOG SIGNALLING KARO BIO AB (SE) 2009-07-02 WO disclosed
EP-2024336-A1 NOVEL PHARMACEUTICAL COMPOSITIONS KARO BIO AB (SE) 2009-02-18 EP disclosed
WO-2007128492-A1 NOVEL PHARMACEUTICAL COMPOSITIONS KARO BIO AB (SE) 2007-11-15 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-20090318514-A1 Novel Pharmaceutical Compositions TSHR, TRHR, THRA MAPT 3554/4885TP53 1161/4885SMN1; SMN2 4396/4885

“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.