SCHEMBL18711900

SCHEMBL18711900

CC(=O)N1C2CCC1CN(C1CCC1)C2

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.37
SPR P35270 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
GAA P10253 1/20 0.33
ALDH1A1 P00352 3/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
KDM4E B2RXH2 2/20 0.32
KDM2B Q8NHM5 1/20 0.31
RECQL P46063 1/20 0.31
SIGMAR1 Q99720 1/20 0.30

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
SCHEMBL18711898 0.94 SMN1; SMN2 (0.42) SMN1; SMN2ALDH1A1KDM4E
SCHEMBL21480134 0.84 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1CHRM2CHRM4CHRM1
SCHEMBL12357446 0.84 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1CHRM2CHRM4CHRM1
SCHEMBL18701905 0.80 MEN1 (0.40) SPRMEN1KMT2AGAAALDH1A1
SCHEMBL14110948 0.77 SMN1; SMN2 (0.53) SMN1; SMN2CHRM2CHRM1CHRM3
SCHEMBL15198072 0.76 SMN1; SMN2 (0.42) SMN1; SMN2ALDH1A1
SCHEMBL26031625 0.74 SMN1; SMN2 (0.40) SMN1; SMN2
SCHEMBL16446458 0.73 CHRNB2 (0.34) SMN1; SMN2
SCHEMBL18702146 0.72 CHRM2 (0.35) MEN1KMT2AALDH1A1CHRM2CHRM1
SCHEMBL20690443 0.72 SMN1; SMN2 (0.39) SMN1; SMN2MEN1KMT2AALDH1A1CHRM2

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-20170096435-A1 SEPIAPTERIN REDUCTASE INHIBITORS MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E.V. (DE) 2017-04-06 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-20170096435-A1 SEPIAPTERIN REDUCTASE INHIBITORS SPR, QDPR, SRR SMN1; SMN2 2655/4885SPR 1/4885MEN1 4876/4885

“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.