SCHEMBL4238154

SCHEMBL4238154

Nc1nc2c(C(=O)NCc3cc4ccccc4s3)cccc2[nH]1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 5/20 0.44
LOX P28300 4/20 0.44
KDM4C Q9H3R0 1/20 0.41
HDAC1 Q13547 1/20 0.41
CYP2A6 P11509 3/20 0.40
ADRB2 P07550 1/20 0.40
PRSS12 P56730 1/20 0.40
RAD52 P43351 1/20 0.38
UHRF1 Q96T88 1/20 0.38
PIN1 Q13526 1/20 0.38
KDM4E B2RXH2 1/20 0.37
HSD17B10 Q99714 1/20 0.37
ASIC3 Q9UHC3 1/20 0.37
MAPT P10636 1/20 0.37
PKN1 Q16512 1/20 0.37
PKN2 Q16513 1/20 0.37
RAB9A P51151 1/20 0.37
HDAC2 Q92769 1/20 0.37
CNR2 P34972 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL4238148 0.88 LOX (0.42) LOXL2LOXKDM4CCYP2A6ADRB2
SCHEMBL4241730 0.81 KLKB1 (0.45) KDM4EASIC3MAPTRAB9ACNR2
SCHEMBL4244395 0.80 HPGD (0.52) KDM4EHSD17B10MAPTSMN1; SMN2
SCHEMBL1202090 0.79 LOX (0.40) LOXL2LOXKDM4CHDAC1CYP2A6
SCHEMBL4240730 0.76 RAB9A (0.65) HDAC1KDM4EHSD17B10MAPTRAB9A
SCHEMBL4239974 0.76 HPGD (0.56) KDM4EHSD17B10MAPTSMN1; SMN2
SCHEMBL24754416 0.75 PARP1 (0.51) RAD52UHRF1PKN1PKN2
SCHEMBL4243741 0.74 PSMD14 (0.47) RAD52UHRF1PKN1PKN2RAB9A
SCHEMBL4244447 0.74 MAPT (0.47) RAD52UHRF1KDM4EHSD17B10MAPT
SCHEMBL24112332 0.74 PKN1 (0.61) PKN1PKN2

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-8598353-B2 Benzazole derivatives, compositions, and methods of use as β-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2013-12-03 US claimed
EP-1863771-A2 BENZAZOLE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE AS B-SECRETASE INHIBITORS Transtech Pharma, Inc. (US) 2007-12-12 EP claimed
US-20060223849-A1 Benzazole derivatives, compositions, and methods of use as beta-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC 2006-10-05 US claimed
WO-2006099379-A2 BENZAZOLE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE AS B-SECRETASE INHIBITORS TRANSTECH PHARMA, INC. (US) 2006-09-21 WO claimed
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-8598353-B2 Benzazole derivatives, compositions, and methods of use as β-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2013-12-03 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-20090326006-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors VTVX HOLDINGS II LLC 2009-12-31 US disclosed
US-20060223849-A1 Benzazole derivatives, compositions, and methods of use as beta-secretase inhibitors HIGH POINT PHARMACEUTICALS, LLC 2006-10-05 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 LOXL2 2913/4885LOX 1040/4885KDM4C 2977/4885
US-20060223849-A1 Benzazole derivatives, compositions, and methods of use as beta-secretase inhibitors BACE1, BACE2, APP LOXL2 2913/4885LOX 1040/4885KDM4C 2977/4885
US-20140066477-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors BACE1, BACE2, APP LOXL2 2913/4885LOX 1040/4885KDM4C 2977/4885

“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.