SCHEMBL2074353

SCHEMBL2074353

COc1ccccc1-c1ccc(C(=O)Nc2nc3c(C(=O)Nc4ncc[nH]4)cccc3[nH]2)cn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.52
ADORA2A P29274 2/20 0.52
RAB9A P51151 10/20 0.48
NPC1 O15118 9/20 0.48
PKM P14618 4/20 0.48
HSP90AA1 P07900 2/20 0.48
PAX8 Q06710 1/20 0.48
SMN1; SMN2 Q16637 6/20 0.44
TP53 P04637 1/20 0.44
PARP1 P09874 1/20 0.43
POLB P06746 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
KLF5 Q13887 1/20 0.42
HPGDS O60760 1/20 0.42
USP2 O75604 1/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
FGFR3 P22607 1/20 0.40
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL1202055 0.86 RAB9A (0.50) MAOBADORA2ARAB9ANPC1PKM
SCHEMBL1201598 0.86 HPGDS (0.49) MAOBADORA2ARAB9ANPC1PKM
SCHEMBL1202172 0.85 MAOB (0.46) MAOBADORA2ARAB9ANPC1PKM
SCHEMBL1201007 0.83 NPC1 (0.47) MAOBADORA2ARAB9ANPC1PKM
SCHEMBL1202076 0.79 TRPV1 (0.43) MAOBADORA2ARAB9ANPC1PKM
SCHEMBL1201393 0.79 HDAC2 (0.51) MAOBADORA2ARAB9ANPC1PARP1
SCHEMBL1202448 0.79 NPC1 (0.43) MAOBADORA2ARAB9ANPC1PKM
SCHEMBL1200911 0.79 MTOR (0.52) RAB9ANPC1PKMHPGDSMEN1
SCHEMBL1202079 0.78 MAOB (0.53) MAOBADORA2ARAB9ANPC1PKM
SCHEMBL1201114 0.78 RAB9A (0.48) MAOBADORA2ARAB9ANPC1PKM

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 1 patent. 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 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-20110065713-A1 Benzazole Derivatives, Compositions, and Methods of Use as B-Secretase Inhibitors BACE1, BACE2, APP MAOB 127/4885ADORA2A 3347/4885RAB9A 2474/4885

“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.