SCHEMBL1768752

SCHEMBL1768752

CC(c1ccncc1)[C@H](N)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRCP P42785 1/20 0.49
DPP4 P27487 3/20 0.44
GRM8 O00222 1/20 0.42
GRM4 Q14833 1/20 0.42
ROCK2 O75116 2/20 0.41
ROCK1 Q13464 2/20 0.41
DPP7 Q9UHL4 1/20 0.41
SLC7A5 Q01650 1/20 0.41
AKR1C3 P42330 1/20 0.40
AKR1C2 P52895 1/20 0.40
NAPRT Q6XQN6 1/20 0.39
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
GAA P10253 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
CYP19A1 P11511 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37

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
SCHEMBL31000654 1.00 PRCP (0.49) PRCPDPP4GRM8GRM4ROCK2
SCHEMBL31000717 1.00 PRCP (0.49) PRCPDPP4GRM8GRM4ROCK2
SCHEMBL1768751 1.00 PRCP (0.49) PRCPDPP4GRM8GRM4ROCK2
SCHEMBL4128071 0.86 PRCP (0.42) PRCPDPP4GRM8GRM4ROCK2
SCHEMBL24156377 0.82 DPP4 (0.51) DPP4SLC7A5ALDH1A1
SCHEMBL383451 0.82 DPP4 (0.51) DPP4SLC7A5ALDH1A1
SCHEMBL30360242 0.82 DPP4 (0.51) DPP4SLC7A5ALDH1A1
SCHEMBL8882516 0.82 DPP4 (0.51) DPP4SLC7A5ALDH1A1
SCHEMBL180086 0.82 DPP4 (0.51) DPP4SLC7A5ALDH1A1
SCHEMBL383452 0.82 DPP4 (0.51) DPP4SLC7A5ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240287138-A1 CYCLIC PEPTIDES FOR INHIBITING TNF RECEPTOR 1 ACTIVITY MERCK SHARP & DOHME LLC 2024-08-29 US disclosed
EP-3280723-B1 BACKBONE-CYCLIZED PEPTIDOMIMETICS POLYPHOR AG (CH) 2021-01-06 EP disclosed
US-10730911-B2 Backbone-cyclized peptidomimetics with GLP-1R modulating activity UNIVERSITAT ZURICH (CH) 2020-08-04 US disclosed
US-9957297-B2 Template-fixed peptidomimetics as inhibitors of FPR1 POLYPHOR AG (CH) 2018-05-01 US disclosed
US-20180072774-A1 BACKBONE-CYCLIZED PEPTIDOMIMETICS WITH GLP-1R MODULATING ACTIVITY POLYPHOR AG (CH) 2018-03-15 US disclosed
EP-3280723-A1 BACKBONE-CYCLIZED PEPTIDOMIMETICS Polyphor AG (CH) 2018-02-14 EP disclosed
EP-2764010-B9 TEMPLATE-FIXED PEPTIDOMIMETICS AS INHIBITORS OF FPR1 POLYPHOR AG (CH) 2017-01-18 EP disclosed
WO-2016162127-A1 BACKBONE-CYCLIZED PEPTIDOMIMETICS POLYPHOR AG (CH) 2016-10-13 WO disclosed
EP-2764010-B1 TEMPLATE-FIXED PEPTIDOMIMETICS AS INHIBITORS OF FPR1 POLYPHOR AG (CH) 2016-03-16 EP disclosed
US-20140287986-A1 TEMPLATE-FIXED PEPTIDOMIMETICS AS INHIBITORS OF FPR1 POLYPHOR AG (CH) 2014-09-25 US disclosed
US-8754038-B2 Template-fixed peptidomimetics with CCR10 antagonistic activity POLYPHOR AG (CH) 2014-06-17 US disclosed
US-20120283168-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVITY POLYPHOR AG (CH) 2012-11-08 US disclosed
EP-2501715-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVTY Polyphor Ag (CH) 2012-09-26 EP disclosed
WO-2011060937-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVTY POLYPHOR AG (CH) 2011-05-26 WO 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 (5 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-20140287986-A1 TEMPLATE-FIXED PEPTIDOMIMETICS AS INHIBITORS OF FPR1 FPR1, FPR3, FPR2 PRCP 1978/4885DPP4 3508/4885GRM8 1063/4885
US-20180072774-A1 BACKBONE-CYCLIZED PEPTIDOMIMETICS WITH GLP-1R MODULATING ACTIVITY GLP1R, GIPR, SSTR1 PRCP 1029/4885DPP4 65/4885GRM8 1338/4885
US-10730911-B2 Backbone-cyclized peptidomimetics with GLP-1R modulating activity GLP1R, GIPR, SSTR1 PRCP 1029/4885DPP4 65/4885GRM8 1338/4885
US-20120283168-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVITY CCR10, CCR1, CCRL2 PRCP 1285/4885DPP4 2377/4885GRM8 1650/4885
US-20240287138-A1 CYCLIC PEPTIDES FOR INHIBITING TNF RECEPTOR 1 ACTIVITY TNF, TNFRSF1A, CD40 PRCP 902/4885DPP4 1135/4885GRM8 3419/4885

“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.