SCHEMBL1768948

SCHEMBL1768948

N[C@@H](CCc1ccccn1)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC1A5 Q15758 2/20 0.56
PTPRA P18433 1/20 0.54
CYP1A2 P05177 3/20 0.50
HRH1 P35367 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
CYP2C19 P33261 1/20 0.50
GRIN2D O15399 1/20 0.47
GRIN3B O60391 1/20 0.47
GRIN1 Q05586 1/20 0.47
GRIN2A Q12879 1/20 0.47
GRIN2B Q13224 1/20 0.47
GRIN2C Q14957 1/20 0.47
GRIN3A Q8TCU5 1/20 0.47
KIF11 P52732 3/20 0.46
KDM4E B2RXH2 1/20 0.44
ALDH1A1 P00352 1/20 0.44
NPSR1 Q6W5P4 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
SCHEMBL30428132 1.00 SLC1A5 (0.56) SLC1A5PTPRACYP1A2HRH1SMN1; SMN2
SCHEMBL1176394 1.00 SLC1A5 (0.56) SLC1A5PTPRACYP1A2HRH1SMN1; SMN2
SCHEMBL28078250 0.90 CYP1A2 (0.55) SLC1A5PTPRACYP1A2HRH1SMN1; SMN2
SCHEMBL28078253 0.90 CYP1A2 (0.55) SLC1A5PTPRACYP1A2HRH1SMN1; SMN2
SCHEMBL28102642 0.88 HRH1 (0.55) SLC1A5PTPRACYP1A2HRH1SMN1; SMN2
SCHEMBL28102643 0.88 HRH1 (0.55) SLC1A5PTPRACYP1A2HRH1SMN1; SMN2
SCHEMBL14795518 0.87 HRH1 (0.50) SLC1A5PTPRACYP1A2HRH1SMN1; SMN2
SCHEMBL7075416 0.84 PTPRA (0.59) PTPRACYP1A2HRH1SMN1; SMN2CYP2C19
D-Glutamate SCHEMBL28565442 0.84 HRH1 (0.57) SLC1A5PTPRACYP1A2HRH1SMN1; SMN2
SCHEMBL126508 0.83 PTPRA (0.67) SLC1A5PTPRACYP1A2SMN1; SMN2CYP2C19

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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11753446-B2 Beta-hairpin peptidomimetics POLYPHOR AG (CH) 2023-09-12 US disclosed
US-11629171-B2 Beta-hairpin peptidomimetics SPEXIS AG (CH) 2023-04-18 US disclosed
CN-115093463-A Beta-hairpin peptidomimetics 波利弗尔股份公司 2022-09-23 CN disclosed
EP-3201219-B1 BETA-HAIRPIN PEPTIDOMIMETICS POLYPHOR AG (CH) 2021-11-17 EP disclosed
EP-3201218-B1 BETA-HAIRPIN PEPTIDOMIMETICS POLYPHOR AG (CH) 2021-11-03 EP disclosed
CN-105324390-B Beta-hairpin peptidomimetics 波利弗尔股份公司 2021-10-19 CN disclosed
US-20210284693-A1 BETA-HAIRPIN PEPTIDOMIMETICS SPEXIS AG (CH) 2021-09-16 US disclosed
CN-105849119-B Beta-hairpin peptidomimetics 波利弗尔股份公司 2021-01-19 CN disclosed
EP-3280723-B1 BACKBONE-CYCLIZED PEPTIDOMIMETICS POLYPHOR AG (CH) 2021-01-06 EP disclosed
US-10829520-B2 Beta-hairpin peptidomimetics POLYPHOR AG (CH) 2020-11-10 US disclosed
WO-2014161782-A1 BETA-HAIRPIN PEPTIDOMIMETICS POLYPHOR AG (CH) 2014-10-09 WO disclosed
WO-2014161781-A1 BETA-HAIRPIN PEPTIDOMIMETICS POLYPHOR AG (CH) 2014-10-09 WO disclosed
US-20140287986-A1 TEMPLATE-FIXED PEPTIDOMIMETICS AS INHIBITORS OF FPR1 POLYPHOR AG (CH) 2014-09-25 US disclosed
EP-2764010-A1 TEMPLATE -FIXED PEPTIDOMIMETICS AS INHIBITORS OF FPR1 Polyphor Ag (CH) 2014-08-13 EP disclosed
US-8754038-B2 Template-fixed peptidomimetics with CCR10 antagonistic activity POLYPHOR AG (CH) 2014-06-17 US disclosed
WO-2013050346-A1 TEMPLATE -FIXED PEPTIDOMIMETICS AS INHIBITORS OF FPR1 POLYPHOR AG (CH) 2013-04-11 WO disclosed
US-20120283168-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVITY POLYPHOR AG (CH) 2012-11-08 US disclosed
CN-102712676-A Template-fixed peptidomimetics with CCR10 antagonistic activty POLYPHOR AG 2012-10-03 CN 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 (6 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 SLC1A5 2090/4885PTPRA 1889/4885CYP1A2 3696/4885
US-20120283168-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH CCR10 ANTAGONISTIC ACTIVITY CCR10, CCR1, CCRL2 SLC1A5 1793/4885PTPRA 1991/4885CYP1A2 4368/4885
US-11629171-B2 Beta-hairpin peptidomimetics POLL, POLQ, HBZ SLC1A5 3359/4885PTPRA 2521/4885CYP1A2 4776/4885
US-20210284693-A1 BETA-HAIRPIN PEPTIDOMIMETICS POLL, POLQ, POLM SLC1A5 3568/4885PTPRA 2822/4885CYP1A2 4541/4885
US-10829520-B2 Beta-hairpin peptidomimetics POLQ, POLL, POLM SLC1A5 3032/4885PTPRA 2526/4885CYP1A2 4770/4885
US-11753446-B2 Beta-hairpin peptidomimetics POLL, BACE1, C1S SLC1A5 4220/4885PTPRA 3196/4885CYP1A2 3983/4885

“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.