SCHEMBL3436141

SCHEMBL3436141

CN(CC(N)=O)C1CCNC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.43
CRBN Q96SW2 1/20 0.43
SLC6A4 P31645 17/20 0.39
SLC6A2 P23975 16/20 0.39
SLC6A3 Q01959 10/20 0.39
NOS3 P29474 1/20 0.36
NOS1 P29475 1/20 0.36
NOS2 P35228 1/20 0.36
KCNH2 Q12809 5/20 0.36
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 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
SCHEMBL3434153 0.90 KDM4E (0.44) DDB1CRBNSLC6A4SLC6A2SLC6A3
SCHEMBL3436142 0.89 DDB1 (0.45) DDB1CRBNSLC6A4SLC6A2SLC6A3
SCHEMBL853339 0.84 SLC6A1 (0.44) SLC6A4SLC6A2SLC6A3NOS3NOS1
SCHEMBL3435014 0.83 DDB1 (0.41) DDB1CRBNSLC6A4SLC6A2SLC6A3
Hydrochloric Acid SCHEMBL6313494 0.82 SLC6A1 (0.43) SLC6A4SLC6A2SLC6A3NOS3NOS1
SCHEMBL31209431 0.79 SLC6A4 (0.38) SLC6A4SLC6A2SLC6A3NOS3NOS1
SCHEMBL2018812 0.78
SCHEMBL3950542 0.78 CA12 (0.41) SLC6A4SLC6A2SLC6A3KCNH2MAPT
SCHEMBL13221613 0.78 CA12 (0.41) SLC6A4SLC6A2SLC6A3KCNH2MAPT
SCHEMBL8418672 0.77 DDB1 (0.46) DDB1CRBNKMT2A

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-8163746-B2 Azolecarboxamide derivative ASTELLAS PHARMA INC. (JP) 2012-04-24 US disclosed
US-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2009-11-19 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-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE GPR17, NTRK1, TRPV1 DDB1 3850/4885CRBN 1103/4885SLC6A4 2509/4885

“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.