SCHEMBL11520

SCHEMBL11520

Cc1ccccc1-c1ccc2ncc(CCC(=O)N(C)C3CCCCC3)cc2c1

nearest known ligand 0.70

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 9/20 0.70
PDE3B Q13370 5/20 0.46
PDE3A Q14432 5/20 0.46
P2RY12 Q9H244 5/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
RAB9A P51151 1/20 0.44
MAPT P10636 2/20 0.44
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43
HSD17B10 Q99714 1/20 0.43
PDE2A O00408 3/20 0.42
MAP4K4 O95819 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL14321746 0.87 BACE1 (0.52) BACE1PDE3BPDE3AP2RY12MEN1
SCHEMBL9829 0.83 BACE1 (1.00) BACE1
SCHEMBL17620324 0.70 BACE1 (0.78) BACE1
SCHEMBL1767850 0.69 LCK (0.47) BACE1ALDH1A1LMNATSHRHSD17B10
SCHEMBL9434 0.69 BACE1 (0.50) BACE1
SCHEMBL14321730 0.69 BACE1 (0.60) BACE1
SCHEMBL9435 0.68 BACE1 (0.49) BACE1
SCHEMBL9433 0.68 BACE1 (0.49) BACE1
SCHEMBL9425 0.67 BACE1 (0.56) BACE1ALDH1A1TSHRHSD17B10
SCHEMBL9424 0.67 BACE1 (0.56) BACE1ALDH1A1TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9296698-B2 Amino heteroaryl compounds as beta-secretase modulators and methods of use AMGEN INC. (US) 2016-03-29 US disclosed
US-20120329830-A1 Amino Heteroaryl Compounds as Beta-Secretase Modulators and Methods of Use AMGEN INC. (US) 2012-12-27 US disclosed
EP-2504315-A1 AMINO HETEROARYL COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE Amgen Inc. (US) 2012-10-03 EP disclosed
WO-2011063233-A1 AMINO HETEROARYL COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2011-05-26 WO 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-20120329830-A1 Amino Heteroaryl Compounds as Beta-Secretase Modulators and Methods of Use BACE1, BACE2, APP BACE1 1/4885PDE3B 970/4885PDE3A 1709/4885

“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.