SCHEMBL3435570

SCHEMBL3435570

N#CCc1ccc(N)c(C2=CCN(CC(N)=O)CC2)c1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CCNT1 O60563 5/20 0.38
CDK9 P50750 5/20 0.38
WNT3A P56704 1/20 0.37
KMT2A Q03164 3/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
SUV39H2 Q9H5I1 2/20 0.36
JAK1 P23458 1/20 0.34
MAPT P10636 3/20 0.34
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 2/20 0.34
LMNA P02545 2/20 0.34
HDAC4 P56524 1/20 0.34
CSF1R P07333 1/20 0.34
TRPV1 Q8NER1 1/20 0.33
DRD2 P14416 1/20 0.33
HTR6 P50406 1/20 0.33
GAA P10253 1/20 0.32

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
SCHEMBL3567115 0.88 CCNT1 (0.41) CCNT1CDK9WNT3AKMT2ASMN1; SMN2
SCHEMBL3435568 0.84 CCNT1 (0.41) CCNT1CDK9WNT3AKMT2ASMN1; SMN2
SCHEMBL13999785 0.83 CCNT1 (0.35) CCNT1CDK9JAK1DRD2HTR6
SCHEMBL3434233 0.80 CDK9 (0.52) CCNT1CDK9LMNA
SCHEMBL2078054 0.80 KDM4E (0.43) CCNT1CDK9KMT2ASMN1; SMN2SUV39H2
SCHEMBL3436177 0.78 PDK4 (0.52) JAK1HTR6
SCHEMBL3435127 0.73 HSP90AA1 (0.39) MAPTKDM4EGAA
SCHEMBL3434596 0.73 CCNT1 (0.52) CCNT1CDK9LMNADRD2
SCHEMBL3435722 0.72 CCNT1 (0.40) CCNT1CDK9KMT2ASMN1; SMN2MAPT
SCHEMBL3436692 0.72 CCNT1 (0.44) CCNT1CDK9WNT3AKMT2ASMN1; SMN2

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 CCNT1 3047/4885CDK9 648/4885WNT3A 3657/4885

“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.