SCHEMBL6488952

SCHEMBL6488952

Cc1nc(C2CNCCN2CC(=O)Nc2cc(OC3CCNCC3)ccc2C)c2c(C)cccc2n1

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 11/20 0.38
HRH3 Q9Y5N1 6/20 0.38
IGF1R P08069 1/20 0.34
WNT1 P04628 2/20 0.34
GSK3B P49841 2/20 0.34
DYRK1A Q13627 2/20 0.34
MAOA P21397 1/20 0.34

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
SCHEMBL6487979 0.66 POLB (0.36)
SCHEMBL6332549 0.66 HRH3 (0.39) KDM1AHRH3MAOA
SCHEMBL6332552 0.66 HRH3 (0.39) KDM1AHRH3MAOA
SCHEMBL7661587 0.65 P2RX7 (0.70)
SCHEMBL6532214 0.63 HRH3 (0.36) KDM1AHRH3
Piperazine SCHEMBL27572562 0.62 ALDH1A1 (0.34)
SCHEMBL214697 0.62 KDM1A (0.42) KDM1AWNT1GSK3BDYRK1AMAOA
SCHEMBL214698 0.62 KMT2A (0.46) KDM1A
SCHEMBL6476996 0.61 OPRK1 (0.59) DYRK1A
SCHEMBL6478290 0.60 OPRK1 (0.61) DYRK1A

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-20050272745-A1 Novel piperidine and piperazine derivatives ASTRAZENECA AB 2005-12-08 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-20050272745-A1 Novel piperidine and piperazine derivatives CYP3A5, IL5, ABCC5 KDM1A 1113/4885HRH3 1123/4885IGF1R 3378/4885

“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.