SCHEMBL9384

SCHEMBL9384

NC(=O)CCCC1CCCCO1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
POLB P06746 1/20 0.45
USP2 O75604 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HPGD P15428 3/20 0.44
TP53 P04637 1/20 0.44
ALOX12 P18054 1/20 0.44
ALDH1A1 P00352 1/20 0.39
HTT P42858 1/20 0.38
PDE8B O95263 1/20 0.38
EPHX1 P07099 1/20 0.37

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
SCHEMBL14322076 0.94 LMNA (0.50) LMNAPOLBUSP2SMN1; SMN2HPGD
Hydrochloric Acid SCHEMBL27859545 0.89 LMNA (0.41) LMNAPOLBUSP2SMN1; SMN2HPGD
SCHEMBL1705701 0.89 HPGD (0.51) LMNAPOLBUSP2SMN1; SMN2HPGD
SCHEMBL2656786 0.85 LMNA (0.47) LMNAPOLBUSP2SMN1; SMN2HPGD
SCHEMBL1916142 0.80 ALDH1A1 (0.49) LMNAPOLBUSP2SMN1; SMN2HPGD
SCHEMBL2398531 0.80 ALDH1A1 (0.49) LMNAPOLBUSP2SMN1; SMN2HPGD
SCHEMBL2398393 0.80 ALDH1A1 (0.49) LMNAPOLBUSP2SMN1; SMN2HPGD
SCHEMBL23501583 0.80 LMNA (0.51) LMNAPOLBUSP2SMN1; SMN2HPGD
SCHEMBL15822139 0.80 EPHX1 (0.48) LMNAPOLBUSP2SMN1; SMN2HPGD
SCHEMBL2481405 0.79 ALDH1A1 (0.56) LMNAPOLBUSP2SMN1; SMN2HPGD

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 LMNA 1486/4885POLB 1921/4885USP2 2045/4885

“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.