SCHEMBL9480

SCHEMBL9480

CC(Cc1cncs1)C(N)=O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PARP15 Q460N3 1/20 0.43
PARP10 Q53GL7 1/20 0.43
SLC6A3 Q01959 11/20 0.38
ACACB O00763 2/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
LRRK2 Q5S007 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
BACE1 P56817 1/20 0.36
SLC6A2 P23975 4/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL3659943 0.81 PARP15 (0.44) PARP15PARP10SLC6A3ACACBNPC1
SCHEMBL21064799 0.74 SLC7A5 (0.47) PARP15PARP10SLC6A3TDP1LMNA
SCHEMBL2727898 0.74 SLC7A5 (0.47) PARP15PARP10SLC6A3TDP1LMNA
SCHEMBL2727900 0.74 SLC7A5 (0.47) PARP15PARP10SLC6A3TDP1LMNA
SCHEMBL7982479 0.73 ACACB (0.46) SLC6A3ACACBNPC1RAB9ASMN1; SMN2
SCHEMBL951450 0.72 CYP1A2 (0.45) PARP15PARP10SLC6A3RAB9ATDP1
SCHEMBL24924285 0.72
SCHEMBL954216 0.72
SCHEMBL469204 0.71 SLC6A3 (0.38) SLC6A3ACACBSLC6A2
SCHEMBL13995170 0.70 SCN10A (0.36) SLC6A3SLC6A2

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 PARP15 222/4885PARP10 307/4885SLC6A3 3629/4885

“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.