SCHEMBL29541503

SCHEMBL29541503

COC(=O)[C@@H]1CN(C2CCCCC2)CC[C@H]1N

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.44
ACKR3 P25106 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
POLB P06746 2/20 0.36
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36
SLC6A3 Q01959 2/20 0.36
KDM2B Q8NHM5 5/20 0.36
HSD17B10 Q99714 1/20 0.36
SIGMAR1 Q99720 2/20 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
SCHEMBL19814829 1.00 DPP4 (0.44) DPP4ACKR3SMN1; SMN2POLBSLC6A2
SCHEMBL19816437 0.98 DPP4 (0.42) DPP4ACKR3SMN1; SMN2SLC6A2SLC6A4
SCHEMBL29775816 0.98 DPP4 (0.42) DPP4ACKR3SMN1; SMN2SLC6A2SLC6A4
SCHEMBL19814563 0.81 DPP4 (0.45) DPP4ACKR3SMN1; SMN2POLBKDM2B
SCHEMBL28331059 0.81 DPP4 (0.45) DPP4ACKR3SMN1; SMN2POLBKDM2B
SCHEMBL19616801 0.79 SMN1; SMN2 (0.56) SMN1; SMN2POLBKDM2BHSD17B10
SCHEMBL19814406 0.79 DPP4 (0.44) DPP4ACKR3KDM2B
SCHEMBL28332554 0.79 DPP4 (0.44) DPP4ACKR3KDM2B
SCHEMBL29775873 0.78 ACKR3 (0.37) ACKR3SLC6A2SLC6A4SLC6A3
SCHEMBL19815189 0.78 ACKR3 (0.37) ACKR3SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109563085-B Piperidine CXCR7 receptor modulators 爱杜西亚药品有限公司 2022-08-09 CN disclosed
CN-110563717-B Piperidine CXCR7 receptor modulators 爱杜西亚药品有限公司 2022-08-09 CN disclosed
US-11306078-B2 Piperidine CXCR7 receptor modulators IDORSIA PHARMACEUTICALS LTD. (CH) 2022-04-19 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-11306078-B2 Piperidine CXCR7 receptor modulators CXCR1, CXCR5, ACKR3 DPP4 2777/4885ACKR3 3/4885SMN1; SMN2 4303/4885

“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.