SCHEMBL1953200

SCHEMBL1953200

COCCOCCOCC(=O)NCCCCC(N)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ OTC P00480 1/20 0.49
▸ DDAH1 O94760 2/20 0.46
▸ GLP1R P43220 8/20 0.42
▸ NOD1 Q9Y239 2/20 0.40
▸ TSHR P16473 2/20 0.40
▸ NOS3 P29474 2/20 0.39
▸ NOS1 P29475 2/20 0.39
▸ NOS2 P35228 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ GSR P00390 1/20 0.39

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
SCHEMBL30409031 1.00 OTC (0.49) OTCDDAH1GLP1RNOD1TSHR
SCHEMBL19019937 0.99 OTC (0.50) OTCDDAH1GLP1RNOD1TSHR
SCHEMBL1951953 0.99 OTC (0.50) OTCDDAH1GLP1RNOD1TSHR
SCHEMBL24788157 0.97 OTC (0.47) OTCDDAH1GLP1RNOD1TSHR
SCHEMBL24788082 0.92 GLP1R (0.45) OTCDDAH1GLP1RNOD1TSHR
SCHEMBL3043120 0.90 DDAH1 (0.43) OTCDDAH1GLP1RTSHRNOS3
SCHEMBL24229748 0.89 OTC (0.49) OTCDDAH1GLP1RNOD1TSHR
SCHEMBL21738833 0.89 OTC (0.49) OTCDDAH1GLP1RNOD1TSHR
SCHEMBL17346257 0.89 OTC (0.49) OTCDDAH1GLP1RNOD1TSHR
SCHEMBL29221102 0.89 OTC (0.49) OTCDDAH1GLP1RNOD1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10730912-B2 Template-fixed peptidomimetics with antimicrobial activity POLYPHOR LTD. (CH) 2020-08-04 — — US disclosed
US-10562933-B2 Template-fixed beta-hairpin peptidomimetics with protease inhibitory activity POLYPHOR LTD. (CH) 2020-02-18 — — US disclosed
US-20190002498-A1 TEMPLATE-FIXED BETA-HAIRPIN PEPTIDOMIMETICS WITH PROTEASE INHIBITORY ACTIVITY POLYPHOR LTD (CH) 2019-01-03 — — US disclosed
US-10100084-B2 Template-fixed beta-hairpin peptidomimetics with protease inhibitory activity POLYPHOR LTD. (CH) 2018-10-16 — — US disclosed
US-20170107259-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH ANTIMICROBIAL ACTIVITY POLYPHOR LTD. (CH) 2017-04-20 — — US disclosed
US-9596852-B2 Template-fixed peptidomimetics with antimicrobial activity POLYPHOR LTD. (CH) 2017-03-21 — — US disclosed
US-9538752-B2 Template-fixed peptidomimetics with antimicrobial activity POLYPHOR LTD. (CH) 2017-01-10 — — US disclosed
US-9521846-B2 Template-fixed peptidomimetics with antimicrobial activity POLYPHOR LTD. (CH) 2016-12-20 — — US disclosed
US-9518092-B2 Template-fixed beta-hairpin peptidomimetics with CXCR4 antagonizing activity POLYPHOR LTD. (CH) 2016-12-13 — — US disclosed
US-20160333051-A1 TEMPLATE-FIXED BETA-HAIRPIN PEPTIDOMIMETICS WITH PROTEASE INHIBITORY ACTIVITY POLYPHOR LTD (CH) 2016-11-17 — — US disclosed
EP-1979374-A2 TEMPLATE-FIXED PEPTIDOMIMETICS Polyphor Ltd. (CH) 2008-10-15 — — EP disclosed
EP-1879911-A1 DYE CONJUGATES OF TEMPLATE-FIXED PEPTIDOMIMETICS Polyphor Ltd. (CH) 2008-01-23 — — EP disclosed
EP-1856140-A1 TEMPLATE-FIXED BETA-HAIRPIN PEPTIDOMIMETICS WITH PROTEASE INHIBITORY ACTIVITY Polyphor Ltd. (CH) 2007-11-21 — — EP disclosed
WO-2007079597-A1 TEMPLATE - FIXED PEPTIDOMIMETICS WITH ANTIMICROBIAL ACTIVITY POLYPHOR LTD. (CH) 2007-07-19 — — WO disclosed
WO-2007079605-A2 TEMPLATE-FIXED PEPTIDOMIMETICS WITH ANTIMICROBIAL ACTIVITY POLYPHOR LTD. (CH) 2007-07-19 — — WO disclosed
US-20070078079-A1 Template-fixed beta-hairpin peptidomimetics with cxcr4 antagonizing activity POLYPHOR LTD. (CH) 2007-04-05 — — US disclosed
WO-2006117011-A1 DYE CONJUGATES OF TEMPLATE-FIXED PEPTIDOMIMETICS POLYPHOR LTD. (CH) 2006-11-09 — — WO disclosed
WO-2006087001-A1 TEMPLATE-FIXED BETA-HAIRPIN PEPTIDOMIMETICS WITH PROTEASE INHIBITORY ACTIVITY POLYPHOR LTD. (CH) 2006-08-24 — — WO disclosed
EP-1622931-A1 TEMPLATE-FIXED BETA-HAIRPIN PEPTIDOMIMETICS WITH CXCR4 ANTAGONIZING ACTIVITY Polyphor AG (CH) 2006-02-08 — — EP disclosed
WO-2004096840-A1 TEMPLATE- FIXED BETA-HAIRPIN PEPTIDOMIMETICS WITH CXCR4 ANTAGONIZING ACTIVITY POLYPHOR AG (CH) 2004-11-11 — — 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 (7 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-20070078079-A1 Template-fixed beta-hairpin peptidomimetics with cxcr4 antagonizing activity CXCR4, CXCL12, CCR5 OTC 4315/4885DDAH1 2481/4885GLP1R 324/4885
US-10100084-B2 Template-fixed beta-hairpin peptidomimetics with protease inhibitory activity CTSG, CTRL, PREP OTC 4023/4885DDAH1 932/4885GLP1R 662/4885
US-20190002498-A1 TEMPLATE-FIXED BETA-HAIRPIN PEPTIDOMIMETICS WITH PROTEASE INHIBITORY ACTIVITY CTSG, CTRL, PREP OTC 4023/4885DDAH1 932/4885GLP1R 662/4885
US-20160333051-A1 TEMPLATE-FIXED BETA-HAIRPIN PEPTIDOMIMETICS WITH PROTEASE INHIBITORY ACTIVITY CTSG, CTRL, PREP OTC 4023/4885DDAH1 932/4885GLP1R 662/4885
US-20170107259-A1 TEMPLATE-FIXED PEPTIDOMIMETICS WITH ANTIMICROBIAL ACTIVITY POLL, POLM, POLR1C OTC 1971/4885DDAH1 582/4885GLP1R 233/4885
US-10730912-B2 Template-fixed peptidomimetics with antimicrobial activity POLL, POLM, POLR1C OTC 2000/4885DDAH1 583/4885GLP1R 226/4885
US-10562933-B2 Template-fixed beta-hairpin peptidomimetics with protease inhibitory activity CTSG, CTRL, PREP OTC 4023/4885DDAH1 932/4885GLP1R 662/4885

“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.

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