SCHEMBL16675362

SCHEMBL16675362

CCN1CCN(N2CCN(C(=O)OC(C)(C)C)CC2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CHRM2 P08172 1/20 0.47
CHRM4 P08173 1/20 0.47
CHRM1 P11229 1/20 0.47
CHRM3 P20309 1/20 0.47
HPGD P15428 1/20 0.43
HSD11B1 P28845 1/20 0.43
EPHX2 P34913 1/20 0.42
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
RECQL P46063 1/20 0.41
EPHX1 P07099 1/20 0.41
MAPT P10636 2/20 0.41
NPC1 O15118 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
RAB9A P51151 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL863104 0.95 USP2 (0.55) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL2904258 0.88 MEN1 (0.50) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL8242595 0.82 USP2 (0.61) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL20046379 0.82 CNR1 (0.44) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL698803 0.81 USP2 (0.69) USP2SMN1; SMN2HPGDEPHX2ALDH1A1
SCHEMBL18294 0.81 USP2 (0.69) USP2SMN1; SMN2HPGDEPHX2ALDH1A1
SCHEMBL2616174 0.81 USP2 (0.51) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL17271528 0.80 USP2 (0.55) USP2SMN1; SMN2HPGDEPHX2ALDH1A1
SCHEMBL5573083 0.80 USP2 (0.55) USP2SMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL8487157 0.80 HPGD (0.58) USP2SMN1; SMN2HPGDEPHX2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150119373-A1 NOVEL BETULINIC ACID DERIVATIVES AS HIV INHIBITORS HETERO LABS LIMITED (IN) 2015-04-30 US disclosed
US-20150119373-A1 NOVEL BETULINIC ACID DERIVATIVES AS HIV INHIBITORS HETERO LABS LIMITED (IN) 2015-04-30 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-20150119373-A1 NOVEL BETULINIC ACID DERIVATIVES AS HIV INHIBITORS BET1, PGGT1B, RABGGTB USP2 4451/4885SMN1; SMN2 4819/4885CHRM2 4826/4885

“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.