SCHEMBL925194

SCHEMBL925194

CN(C)c1cc(C(=O)O)cn(C2CCCC2)c1=O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.40
GAA P10253 2/20 0.40
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
GRM1 Q13255 6/20 0.36
GRM5 P41594 4/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
HCAR3 P49019 3/20 0.35
TP53 P04637 2/20 0.34
MAPT P10636 1/20 0.33

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
SCHEMBL926212 0.78 HSD17B10 (0.43) HSD17B10GAAKDM4EALDH1A1HPGD
SCHEMBL924275 0.77 GAA (0.40) HSD17B10GAAKDM4EALDH1A1HPGD
SCHEMBL923798 0.75 HSD17B10 (0.39) HSD17B10GAAKDM4EALDH1A1HPGD
SCHEMBL925096 0.74 KDM4E (0.41) HSD17B10GAAKDM4EALDH1A1HPGD
SCHEMBL924196 0.74 ALDH1A1 (0.54) HSD17B10GAAKDM4EALDH1A1HPGD
SCHEMBL25352885 0.74 HSD17B10 (0.48) HSD17B10GAAKDM4EALDH1A1L3MBTL1
SCHEMBL27612290 0.74 NOTUM (0.39) HSD17B10GAAKDM4EALDH1A1HPGD
SCHEMBL924407 0.71 BACE1 (0.47) HSD17B10GAAKDM4EALDH1A1HPGD
SCHEMBL924171 0.70 HSD17B10 (0.42) HSD17B10GAAKDM4EALDH1A1HPGD
SCHEMBL924527 0.69 HSD17B10 (0.49) HSD17B10GAAKDM4EALDH1A1HPGD

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-8163766-B2 Beta-secretase modulators and methods of use AMGEN INC. (US) 2012-04-24 US disclosed
US-20110118250-A1 BETA-SECRETASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2011-05-19 US disclosed
US-7872009-B2 Beta-Secretase modulators and methods of use AMGEN INC. (US) 2011-01-18 US disclosed
US-20070185103-A1 Beta-secretase modulators and methods of use AMGEN INC. 2007-08-09 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 (2 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-20110118250-A1 BETA-SECRETASE MODULATORS AND METHODS OF USE BACE1, BACE2, APP HSD17B10 1966/4885GAA 44/4885KDM4E 1391/4885
US-20070185103-A1 Beta-secretase modulators and methods of use BACE1, BACE2, APP HSD17B10 1966/4885GAA 44/4885KDM4E 1391/4885

“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.