SCHEMBL1201600

SCHEMBL1201600

O=C(Nc1nc2ccccc2[nH]1)c1ccc2[nH]c(NC(=O)c3cc4ccccc4cn3)nc2c1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 13/20 0.60
NPC1 O15118 12/20 0.60
KMT2A Q03164 7/20 0.60
MEN1 O00255 6/20 0.60
SMN1; SMN2 Q16637 7/20 0.58
PKM P14618 5/20 0.58
MAOB P27338 1/20 0.58
ADORA2A P29274 1/20 0.58
TP53 P04637 2/20 0.57
SCD O00767 1/20 0.57
OPRK1 P41145 1/20 0.57
KLF5 Q13887 1/20 0.57
KDM4E B2RXH2 1/20 0.57
HSD17B10 Q99714 1/20 0.57
POLB P06746 1/20 0.56
HTT P42858 1/20 0.56
MAPT P10636 2/20 0.56
LMNA P02545 1/20 0.56
MCL1 Q07820 1/20 0.55

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
SCHEMBL12845946 0.93 RAB9A (0.60) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL1201180 0.91 RAB9A (0.49) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL1201545 0.90 RAB9A (0.50) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL1201612 0.87 TOP1 (0.52) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL1201986 0.87 RAB9A (0.52) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL1201677 0.86 NPC1 (0.57) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL13572153 0.84 RAB9A (0.54) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL1201768 0.84 RAB9A (0.46) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL2131843 0.83 RAB9A (0.47) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL1202206 0.83 NPC1 (0.56) RAB9ANPC1KMT2AMEN1SMN1; 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-20110065713-A1 Benzazole Derivatives, Compositions, and Methods of Use as B-Secretase Inhibitors HIGH POINT PHARMACEUTICALS, LLC (US) 2011-03-17 US 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
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-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 RAB9A 2719/4885NPC1 188/4885KMT2A 4094/4885
US-20110065713-A1 Benzazole Derivatives, Compositions, and Methods of Use as B-Secretase Inhibitors BACE1, BACE2, APP RAB9A 2474/4885NPC1 190/4885KMT2A 4117/4885
US-20140066477-A1 Benzazole Derivatives, Compositions, and Methods of Use as Beta-Secretase Inhibitors BACE1, BACE2, APP RAB9A 2719/4885NPC1 188/4885KMT2A 4094/4885

“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.