SCHEMBL418202

SCHEMBL418202

CC(=O)N1Cc2ccccc2C1C

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.51
NOTUM Q6P988 4/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
LMNA P02545 1/20 0.48
ALDH1A1 P00352 1/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
DRD1 P21728 1/20 0.46
ACE P12821 4/20 0.45
HSD17B3 P37058 1/20 0.45
MTNR1B P49286 1/20 0.43
POLB P06746 1/20 0.43
DPP8 Q6V1X1 2/20 0.40
DPP9 Q86TI2 2/20 0.40
DPP4 P27487 1/20 0.40
FAP Q12884 1/20 0.40
BRS3 P32247 1/20 0.40
DPP7 Q9UHL4 1/20 0.40

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
SCHEMBL23537246 0.84 DRD4 (0.50) DRD4NOTUMSMN1; SMN2LMNAALDH1A1
SCHEMBL10312392 0.83 DRD1 (0.60) NOTUMSMN1; SMN2DRD1ACEMTNR1B
SCHEMBL18711615 0.83 DRD1 (0.60) NOTUMSMN1; SMN2DRD1ACEMTNR1B
SCHEMBL29854102 0.81 DRD4 (0.48) DRD4NOTUMSMN1; SMN2LMNAALDH1A1
SCHEMBL418053 0.81 DRD4 (0.54) DRD4SMN1; SMN2LMNADRD1ACE
SCHEMBL18711185 0.79 DRD4 (0.46) DRD4ALDH1A1MAPTKMT2ADRD1
SCHEMBL8222337 0.78 DRD4 (0.48) DRD4KMT2ADRD1
SCHEMBL29074413 0.77 SLC6A2 (0.45) DRD4SMN1; SMN2LMNAMAPTKMT2A
SCHEMBL419149 0.75 NOTUM (0.56) NOTUMALDH1A1ACEHSD17B3MTNR1B
SCHEMBL20738534 0.75 NOTUM (0.56) NOTUMALDH1A1ACEHSD17B3MTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2616808-B1 PROLYL ENDOPEPTIDASE PROBES STANFORD RES INST INT (US) 2015-02-25 EP disclosed
EP-2616808-B1 PROLYL ENDOPEPTIDASE PROBES STANFORD RES INST INT (US) 2015-02-25 EP disclosed
WO-2012037044-A2 PROLYL ENDOPEPTIDASE PROBES SRI INTERNATIONAL (US) 2012-03-22 WO disclosed
US-20120065103-A1 Prolyl Endopeptidase Probes SRI INTERNATIONAL 2012-03-15 US disclosed
US-20120065103-A1 Prolyl Endopeptidase Probes SRI INTERNATIONAL 2012-03-15 US disclosed
US-20120065103-A1 Prolyl Endopeptidase Probes SRI INTERNATIONAL 2012-03-15 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-20120065103-A1 Prolyl Endopeptidase Probes PREP, XPNPEP1, ANPEP DRD4 3994/4885NOTUM 1014/4885SMN1; SMN2 4883/4885

“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.