SCHEMBL9925504

SCHEMBL9925504

C=C1OB(c2ccc(C(C)(c3ccc(OCc4ncccn4)cn3)C(C)C)cc2)OC1(C)C

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 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
SCHEMBL9924163 0.87 ALOX5AP (0.42) ALOX5AP
SCHEMBL9925609 0.82 ALOX5AP (0.34) ALOX5AP
SCHEMBL14396685 0.77 ALOX5AP (0.48) ALOX5AP
SCHEMBL9924146 0.77 ALOX5AP (0.55) ALOX5AP
SCHEMBL2991794 0.77 AAK1 (0.44) ALOX5AP
SCHEMBL708933 0.76 ALOX5AP (0.48) ALOX5AP
SCHEMBL9924098 0.74 ALOX5AP (0.48) ALOX5AP
SCHEMBL13268141 0.73 LMNA (0.31)
SCHEMBL9925596 0.71 ALOX5AP (0.43) ALOX5AP
SCHEMBL706834 0.69 ALOX5AP (0.72) ALOX5AP

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-20120149674-A1 Diaryl Substituted Alkanes MERCK SHARPE & DOHME CORP. (US) 2012-06-14 US disclosed
US-8124628-B2 Diaryl substituted alkanes MERCK SHARP & DOHME CORP. (US) 2012-02-28 US disclosed
US-20090258851-A1 DIARYL SUBSTITUTED ALKANES MERCK SHARP & DOHME CORP. 2009-10-15 US 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 (2 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-20120149674-A1 Diaryl Substituted Alkanes ALOX5, ALOX15, LTB4R2 ALOX5AP 13/4885
US-20090258851-A1 DIARYL SUBSTITUTED ALKANES ALOX5, ALOX15, LTB4R2 ALOX5AP 13/4885

“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.