SCHEMBL1201475

SCHEMBL1201475

CC(C)Oc1ccc2cnc(C(=O)Nc3nc4c(C(=O)Nc5ncc[nH]5)cccc4[nH]3)cc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
KLF5 Q13887 1/20 0.44
HPGDS O60760 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.38
PTGES O14684 3/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
PTGDR Q13258 1/20 0.36
CBLB Q13191 4/20 0.36
HSP90AA1 P07900 1/20 0.36
PKM P14618 1/20 0.36
PAX8 Q06710 1/20 0.36
MAOB P27338 2/20 0.36
ADORA2A P29274 2/20 0.36
ABL1 P00519 1/20 0.36
ADORA2B P29275 1/20 0.35
ADORA1 P30542 1/20 0.35
PDE3B Q13370 1/20 0.35

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
SCHEMBL1202254 0.92 HPGDS (0.50) NPC1RAB9AKLF5HPGDSSMN1; SMN2
SCHEMBL1201666 0.90 HPGDS (0.41) NPC1RAB9AHPGDSSMN1; SMN2PTGES
SCHEMBL1202464 0.89 HPGDS (0.51) NPC1RAB9AKLF5HPGDSSMN1; SMN2
SCHEMBL8261431 0.89 RIPK1 (0.41) NPC1RAB9AHPGDSPTGESMEN1
SCHEMBL1201879 0.88 MAOB (0.43) NPC1RAB9AKLF5HPGDSSMN1; SMN2
SCHEMBL1202540 0.86 ABL1 (0.41) NPC1RAB9AHPGDSMEN1KMT2A
SCHEMBL1202082 0.86 DHODH (0.43) HPGDSMAOBADORA2AADORA2BADORA1
SCHEMBL1202361 0.84 RAB9A (0.47) NPC1RAB9AKLF5HPGDSSMN1; SMN2
SCHEMBL1201827 0.84 DHODH (0.44) HPGDSMAOBADORA2AADORA2BADORA1
SCHEMBL1202007 0.83 RAB9A (0.48) NPC1RAB9AKLF5HPGDSSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8946259-B2 Benzazole derivatives, compositions, and methods of use as beta-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2015-02-03 US disclosed
US-20140066477-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2014-03-06 US disclosed
US-20110065713-A1 Benzazole Derivatives, Compositions, and Methods of Use as B-Secretase Inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2011-03-17 US disclosed
US-20110065713-A1 Benzazole Derivatives, Compositions, and Methods of Use as B-Secretase Inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2011-03-17 US disclosed
US-7893267-B2 Benzazole derivatives, compositions, and methods of use as β-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2011-02-22 US disclosed
US-7893267-B2 Benzazole derivatives, compositions, and methods of use as β-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2011-02-22 US disclosed
US-7893267-B2 Benzazole derivatives, compositions, and methods of use as β-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2011-02-22 US disclosed
US-20090326006-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors VTVX HOLDINGS II LLC 2009-12-31 US disclosed
US-20090326006-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors VTVX HOLDINGS II LLC 2009-12-31 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 (3 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-20090326006-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors BACE1, BACE2, APP NPC1 188/4885RAB9A 2719/4885KLF5 1757/4885
US-20110065713-A1 Benzazole Derivatives, Compositions, and Methods of Use as B-Secretase Inhibitors BACE1, BACE2, APP NPC1 190/4885RAB9A 2474/4885KLF5 2330/4885
US-20140066477-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors BACE1, BACE2, APP NPC1 188/4885RAB9A 2719/4885KLF5 1757/4885

“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.