SCHEMBL9434

SCHEMBL9434

Cc1ccccc1-c1ccc2ncc(C(=CC(N)=O)CCC3CCCCC3)cc2c1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 14/20 0.50
ABL1 P00519 1/20 0.39
LCK P06239 2/20 0.39
KDR P35968 2/20 0.39
JAK3 P52333 1/20 0.39
MAPK14 Q16539 1/20 0.39
CTSD P07339 2/20 0.39
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
LDLR P01130 1/20 0.38
CCR1 P32246 1/20 0.37
KIT P10721 1/20 0.36
SRC P12931 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
SCHEMBL9435 0.79 BACE1 (0.49) BACE1ABL1LCKKDRJAK3
SCHEMBL9433 0.79 BACE1 (0.49) BACE1ABL1LCKKDRJAK3
SCHEMBL9425 0.78 BACE1 (0.56) BACE1ABL1MAPK14HDAC1HDAC2
SCHEMBL9424 0.78 BACE1 (0.56) BACE1ABL1MAPK14HDAC1HDAC2
SCHEMBL11520 0.69 BACE1 (0.70) BACE1
SCHEMBL8630 0.69 BACE1 (0.84) BACE1CTSD
SCHEMBL14321730 0.69 BACE1 (0.60) BACE1ABL1LCKKDRJAK3
SCHEMBL9715 0.69 LCK (0.44) BACE1ABL1LCKKDRJAK3
SCHEMBL8477 0.69 LCK (0.44) BACE1ABL1LCKKDRJAK3
SCHEMBL17620296 0.67 BACE1 (1.00) BACE1CTSD

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 1/4885ABL1 3563/4885LCK 3756/4885

“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.