SCHEMBL5456476

SCHEMBL5456476

O=C(Cl)c1ccc(C2CCCCN2C(=O)OCc2ccccc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.63
TMEM97 Q5BJF2 6/20 0.63
KDM1A O60341 1/20 0.48
RCOR1 Q9UKL0 1/20 0.48
PREP P48147 2/20 0.46
FKBP1A P62942 2/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL4123903 0.97 TMEM97 (0.58) SIGMAR1TMEM97KDM1ARCOR1PREP
SCHEMBL5474103 0.91 TMEM97 (0.65) SIGMAR1TMEM97KDM1ARCOR1PREP
SCHEMBL4033512 0.89 TMEM97 (0.68) SIGMAR1TMEM97PREPFKBP1ANPC1
SCHEMBL27924857 0.89 TMEM97 (0.63) SIGMAR1TMEM97KDM1ARCOR1PREP
Water SCHEMBL27700641 0.88 TMEM97 (0.67) SIGMAR1TMEM97PREPFKBP1ANPC1
SCHEMBL27924834 0.88 TMEM97 (0.62) SIGMAR1TMEM97KDM1ARCOR1PREP
SCHEMBL4122759 0.87 TMEM97 (0.60) SIGMAR1TMEM97KDM1ARCOR1PREP
Water SCHEMBL27740102 0.87 TMEM97 (0.66) SIGMAR1TMEM97PREPFKBP1ANPC1
SCHEMBL5466528 0.87 TMEM97 (0.63) SIGMAR1TMEM97KDM1ARCOR1PREP
SCHEMBL18394326 0.85 TMEM97 (0.61) SIGMAR1TMEM97KDM1ARCOR1PREP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070191420-A1 Kinase inhibitors DEVGEN NV 2007-08-16 US disclosed
EP-1715862-A1 KINASE INHIBITORS Devgen NV (BE) 2006-11-02 EP disclosed
WO-2005082367-A1 KINASE INHIBITORS DEVGEN NV (BE) 2005-09-09 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-20070191420-A1 Kinase inhibitors ROCK1, ROCK2, MAP3K20 SIGMAR1 4594/4885TMEM97 4472/4885KDM1A 540/4885

“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.