SCHEMBL1201147

SCHEMBL1201147

CS(=O)(=O)Nc1ccc2cc(C(=O)Nc3nc4cccc(C(=O)Nc5ncc[nH]5)c4[nH]3)ncc2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.38
MAPK10 P53779 1/20 0.37
PIKFYVE Q9Y2I7 1/20 0.35
POLB P06746 1/20 0.35
NPC1 O15118 7/20 0.34
RAB9A P51151 5/20 0.34
JAK2 O60674 1/20 0.34
SMN1; SMN2 Q16637 4/20 0.34
PKM P14618 3/20 0.34
PAX8 Q06710 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
HSP90AA1 P07900 1/20 0.34
CBLB Q13191 1/20 0.34
LMNA P02545 3/20 0.33
PTGES O14684 2/20 0.33
HTT P42858 2/20 0.33
MITF O75030 1/20 0.33
S1PR4 O95977 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL1202178 0.85 NPC1 (0.42) HPGDSPOLBNPC1RAB9ASMN1; SMN2
SCHEMBL1201686 0.82 RAB9A (0.47) HPGDSPOLBNPC1RAB9ASMN1; SMN2
SCHEMBL1201286 0.82 IRAK4 (0.44) HPGDSNPC1RAB9ASMN1; SMN2MEN1
SCHEMBL1201137 0.78 NPC1 (0.38) HPGDSNPC1RAB9ASMN1; SMN2PKM
SCHEMBL1201883 0.78 POLB (0.40) HPGDSPOLBNPC1RAB9ASMN1; SMN2
SCHEMBL1201769 0.77 PTGES (0.36) HPGDSPOLBCBLBPTGESATR
SCHEMBL1201400 0.77 NPC1 (0.48) POLBNPC1RAB9ASMN1; SMN2PKM
SCHEMBL1201182 0.76 NPC1 (0.41) HPGDSPOLBNPC1RAB9ASMN1; SMN2
SCHEMBL1201712 0.75 GPR27 (0.38) HPGDSPOLBSMN1; SMN2LMNAHTT
SCHEMBL1201491 0.75 POLB (0.39) HPGDSPOLBNPC1RAB9ASMN1; 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 10 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
EP-2457901-A1 Benzazole derivatives, compositions, and methods of use as B-secretase inhibitors High Point Pharmaceuticals, LLC (US) 2012-05-30 EP 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 HPGDS 2231/4885MAPK10 4731/4885PIKFYVE 1261/4885
US-20110065713-A1 Benzazole Derivatives, Compositions, and Methods of Use as B-Secretase Inhibitors BACE1, BACE2, APP HPGDS 2366/4885MAPK10 4788/4885PIKFYVE 1384/4885
US-20140066477-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors BACE1, BACE2, APP HPGDS 2231/4885MAPK10 4731/4885PIKFYVE 1261/4885

“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.