SCHEMBL480427

SCHEMBL480427

CCOC(=O)c1cc(-c2ccc(C(C)(c3ccc(-c4cncc(OC)c4)cc3)C(C)C)nc2)on1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 2/20 0.59
MAPT P10636 7/20 0.42
POLB P06746 2/20 0.39
THRB P10828 2/20 0.39
TP53 P04637 4/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
MAPK1 P28482 1/20 0.38
STAT1 P42224 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MKNK1 Q9BUB5 1/20 0.37
MKNK2 Q9HBH9 1/20 0.37
ACR P10323 1/20 0.37
HPGD P15428 2/20 0.37

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
SCHEMBL13230169 0.84 ALOX5AP (0.58) ALOX5APMAPTTP53SMN1; SMN2NPC1
SCHEMBL480281 0.83 ALOX5AP (0.70) ALOX5APMAPTTP53SMN1; SMN2NPC1
SCHEMBL480229 0.83 ALOX5AP (0.70) ALOX5APMAPTTP53SMN1; SMN2NPC1
SCHEMBL13262245 0.79 ALOX5AP (0.59) ALOX5APMKNK1MKNK2
SCHEMBL480222 0.78 ALOX5AP (0.67) ALOX5APMAPK1MKNK1MKNK2
SCHEMBL480248 0.77 ALOX5AP (0.57) ALOX5APMAPTPOLBSMN1; SMN2MAPK1
SCHEMBL480257 0.77 ALOX5AP (0.77) ALOX5APMKNK1MKNK2
SCHEMBL709581 0.76 ALOX5AP (0.56) ALOX5APMAPTTP53SMN1; SMN2NPC1
SCHEMBL480217 0.76 ALOX5AP (0.60) ALOX5APMAPTPOLBSMN1; SMN2MKNK1
SCHEMBL10197150 0.76 ALOX5AP (0.70) ALOX5APMKNK1MKNK2

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-8440672-B2 Diphenyl substituted alkanes MERCK SHARP & DOHME CORP. (US) 2013-05-14 US disclosed
US-8440672-B2 Diphenyl substituted alkanes MERCK SHARP & DOHME CORP. (US) 2013-05-14 US disclosed
EP-2064204-B1 INHIBITORS OF 5 -LIPOXYGENASE ACTIVATING PROTEIN ( FLAP) MERCK SHARP & DOHME (US) 2012-02-01 EP disclosed
US-20100168076-A1 DIPHENYL SUBSTITUTED ALKANES MERCK SHARP & DOHME CORP. 2010-07-01 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 (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-20100168076-A1 DIPHENYL SUBSTITUTED ALKANES ALOX5, ALOX15, ALOX15B ALOX5AP 14/4885MAPT 4793/4885POLB 3271/4885

“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.