SCHEMBL3387629

SCHEMBL3387629

[CH2]c1ccc(-c2ncc(OC)cn2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 2/20 0.52
KDM4E B2RXH2 3/20 0.41
MAPT P10636 3/20 0.41
TP53 P04637 2/20 0.41
DYRK1A Q13627 2/20 0.39
NPC1 O15118 8/20 0.39
RAB9A P51151 6/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HSD17B10 Q99714 2/20 0.39
XDH P47989 1/20 0.37
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
RXFP1 Q9HBX9 1/20 0.37
PDGFRB P09619 1/20 0.37
PDGFRA P16234 1/20 0.37
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
CASP3 P42574 1/20 0.36

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
SCHEMBL14570077 0.82 CLK4 (0.53) CLK4KDM4EMAPTTP53DYRK1A
SCHEMBL9424443 0.80 MEN1 (0.61) CLK4KDM4EMAPTTP53NPC1
SCHEMBL22130189 0.80 KDM4E (0.61) CLK4KDM4EMAPTTP53DYRK1A
SCHEMBL2436276 0.80 CLK4 (0.52) CLK4KDM4EMAPTTP53NPC1
SCHEMBL20460300 0.80 CLK4 (0.52) CLK4KDM4EMAPTTP53NPC1
SCHEMBL23498185 0.79 NPC1 (0.58) CLK4KDM4EMAPTTP53DYRK1A
SCHEMBL3389945 0.78 CLK4 (0.54) CLK4MAPTTP53DYRK1ANPC1
SCHEMBL21643937 0.78 NPC1 (0.54) CLK4KDM4EMAPTDYRK1ANPC1
SCHEMBL10501607 0.77 CLK4 (0.48) CLK4KDM4EMAPTTP53NPC1
SCHEMBL23742278 0.77 CLK4 (0.48) CLK4KDM4EMAPTTP53DYRK1A

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
EP-2207547-A2 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS Amira Pharmaceuticals, Inc. (US) 2010-07-21 EP claimed
WO-2009045700-A2 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. (US) 2009-04-09 WO claimed
US-20100298343-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. 2010-11-25 US disclosed
EP-2207547-A2 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS Amira Pharmaceuticals, Inc. (US) 2010-07-21 EP disclosed
WO-2009045700-A2 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS AMIRA PHARMACEUTICALS, INC. (US) 2009-04-09 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-20100298343-A1 5-LIPOXYGENASE-ACTIVATING PROTEIN (FLAP) INHIBITORS ALOX5, ALOX15B, ALOX15 CLK4 4075/4885KDM4E 2621/4885MAPT 4848/4885

“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.