SCHEMBL16744141

SCHEMBL16744141

C=CCCCCN1CCN(C(=O)OC(C)(C)C)CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TLR8 Q9NR97 1/20 0.43
EPHX2 P34913 5/20 0.41
CHRM2 P08172 2/20 0.41
CHRM1 P11229 2/20 0.41
CHRM4 P08173 1/20 0.41
CHRM3 P20309 1/20 0.41
ACKR3 P25106 4/20 0.41
SIGMAR1 Q99720 1/20 0.40
KMT5A Q9NQR1 1/20 0.39

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
SCHEMBL15585975 0.99 TLR8 (0.42) USP2SMN1; SMN2TLR8EPHX2CHRM2
SCHEMBL15585997 0.90 USP2 (0.46) USP2SMN1; SMN2TLR8EPHX2CHRM2
SCHEMBL25507305 0.87 ACKR3 (0.44) USP2SMN1; SMN2TLR8EPHX2CHRM2
SCHEMBL8253901 0.86 USP2 (0.51) USP2SMN1; SMN2TLR8EPHX2CHRM2
SCHEMBL1715473 0.86 ACKR3 (0.43) USP2SMN1; SMN2TLR8EPHX2CHRM2
SCHEMBL25507697 0.86 ACKR3 (0.43) USP2SMN1; SMN2TLR8EPHX2CHRM2
SCHEMBL20873847 0.85 USP2 (0.53) USP2SMN1; SMN2TLR8EPHX2CHRM2
SCHEMBL27618607 0.84 TLR8 (0.42) USP2SMN1; SMN2TLR8EPHX2CHRM2
SCHEMBL5544400 0.84 USP2 (0.46) USP2SMN1; SMN2TLR8EPHX2CHRM2
SCHEMBL24568430 0.82 ACKR3 (0.45) USP2SMN1; SMN2TLR8EPHX2CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150148524-A1 AMINO ACID ANALOGUES AND METHODS FOR THEIR SYNTHESIS UNIV MONASH (AU) 2015-05-28 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 (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-20150148524-A1 AMINO ACID ANALOGUES AND METHODS FOR THEIR SYNTHESIS DAO, BCAT2, BCAT1 USP2 2418/4885SMN1; SMN2 3369/4885TLR8 1746/4885

“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.