SCHEMBL21748547

SCHEMBL21748547

CN1CC[C@H](c2cnn(C)c2)[C@@H](NC(=O)O)C1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 4/20 0.52
SSTR1 P30872 3/20 0.45
MAPK1 P28482 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
SLC6A2 P23975 3/20 0.40
SLC6A4 P31645 3/20 0.40
SLC6A3 Q01959 3/20 0.40
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
USP30 Q70CQ3 1/20 0.39
NTRK1 P04629 2/20 0.38
HCAR2 Q8TDS4 1/20 0.38

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
SCHEMBL21748550 1.00 SSTR4 (0.52) SSTR4SSTR1MAPK1HRH3SLC6A2
SCHEMBL21748643 0.88 SSTR4 (0.54) SSTR4SSTR1MAPK1HRH3HDAC3
SCHEMBL21748640 0.88 SSTR4 (0.54) SSTR4SSTR1MAPK1HRH3HDAC3
SCHEMBL21773374 0.80 SSTR4 (0.49) SSTR4SSTR1MAPK1NTRK1
SCHEMBL21773372 0.80 SSTR4 (0.49) SSTR4SSTR1MAPK1NTRK1
SCHEMBL21749026 0.80 SLC6A2 (0.49) HRH3SLC6A2SLC6A4SLC6A3
SCHEMBL21749024 0.80 SLC6A2 (0.49) HRH3SLC6A2SLC6A4SLC6A3
SCHEMBL21749025 0.80 SLC6A2 (0.49) HRH3SLC6A2SLC6A4SLC6A3
SCHEMBL21748758 0.77 HDAC3 (0.42) SSTR4SSTR1MAPK1HRH3HDAC3
SCHEMBL21748756 0.77 HDAC3 (0.42) SSTR4SSTR1MAPK1HRH3HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12005054-B2 Piperidinyl-3-(aryloxy)propanamides and propanoates TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2024-06-11 US disclosed
US-20230021834-A1 PIPERIDINYL-3-(ARYLOXY)PROPANAMIDES AND PROPANOATES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-01-26 US disclosed
US-11045457-B2 Piperidinyl-3-(aryloxy)propanamides and propanoates TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-06-29 US disclosed
US-20200061041-A1 PIPERIDINYL-3-(ARYLOXY)PROPANAMIDES AND PROPANOATES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-02-27 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 (4 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-11045457-B2 Piperidinyl-3-(aryloxy)propanamides and propanoates SSTR4, SSTR3, NPY4R SSTR4 1/4885SSTR1 4/4885MAPK1 3229/4885
US-12005054-B2 Piperidinyl-3-(aryloxy)propanamides and propanoates SSTR4, SSTR3, NPY4R SSTR4 1/4885SSTR1 4/4885MAPK1 3229/4885
US-20200061041-A1 PIPERIDINYL-3-(ARYLOXY)PROPANAMIDES AND PROPANOATES SSTR4, SSTR3, NPY4R SSTR4 1/4885SSTR1 4/4885MAPK1 3229/4885
US-20230021834-A1 PIPERIDINYL-3-(ARYLOXY)PROPANAMIDES AND PROPANOATES SSTR4, SSTR3, NPY4R SSTR4 1/4885SSTR1 4/4885MAPK1 3229/4885

“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.