SCHEMBL3436723

SCHEMBL3436723

Cc1cccnc1N1CCC(C(=O)N2CCCN(C)CC2)CC1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.52
LMNA P02545 3/20 0.51
SMN1; SMN2 Q16637 1/20 0.48
POLB P06746 1/20 0.48
UBE2N P61088 1/20 0.48
KCNH2 Q12809 2/20 0.47
TSHR P16473 2/20 0.46
TRPV1 Q8NER1 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MALT1 Q9UDY8 1/20 0.46
MAPT P10636 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
THRB P10828 1/20 0.44
CHRM4 P08173 1/20 0.44

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
SCHEMBL3436582 0.95 POLB (0.52) LMNASMN1; SMN2POLBUBE2NKCNH2
SCHEMBL3436730 0.91 TRPV1 (0.52) LMNASMN1; SMN2POLBKCNH2TSHR
SCHEMBL3436725 0.83 ELANE (0.53) TSHRTRPV1KMT2AMALT1MAPT
SCHEMBL3436727 0.83 KMT2A (0.52) UBE2NTRPV1MEN1KMT2AMALT1
SCHEMBL3086917 0.83 CNR2 (0.52) SMN1; SMN2TSHRTRPV1MEN1KMT2A
SCHEMBL3436729 0.82 CHRM4 (0.55) HTTSMN1; SMN2POLBTSHRTRPV1
SCHEMBL3436732 0.82 HRH3 (0.48) POLBTSHRTRPV1MEN1KMT2A
SCHEMBL3436721 0.79 ALOX15 (0.58) SMN1; SMN2POLBTSHRKMT2AMAPT
SCHEMBL14818768 0.79 HSD11B1 (0.51) MEN1KMT2A
SCHEMBL238160 0.78 KDM4E (0.60) TRPV1KMT2AMALT1MAPTNPSR1

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 5 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-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
US-20090286766-A1 AZOLECARBOXAMIDE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2009-11-19 US disclosed
EP-2009005-A1 AZOLECARBOXAMIDE DERIVATIVE Astellas Pharma Inc. (JP) 2008-12-31 EP 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 HTT 4067/4885LMNA 4712/4885SMN1; SMN2 3601/4885

“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.