SCHEMBL19375755

SCHEMBL19375755

CNC(=O)[C@H](CCCCNC(=O)COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC)NC(=O)COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOC

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.49
▸ TSHR P16473 1/20 0.37
▸ NAMPT P43490 1/20 0.35
▸ C3AR1 Q16581 1/20 0.34
▸ SIRT1 Q96EB6 3/20 0.34
▸ EPHX2 P34913 2/20 0.34
▸ SIRT6 Q8N6T7 1/20 0.34
▸ MMP1 P03956 1/20 0.33
▸ MMP3 P08254 1/20 0.33
▸ MMP8 P22894 1/20 0.33
▸ SIRT2 Q8IXJ6 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL19375648 1.00 GLP1R (0.49) GLP1RTSHRNAMPTC3AR1SIRT1
SCHEMBL13936568 0.98 GLP1R (0.52) GLP1RTSHRNAMPTC3AR1EPHX2
SCHEMBL13936570 0.95 GLP1R (0.56) GLP1RTSHRNAMPTSIRT1SIRT6
SCHEMBL25585043 0.87 GLP1R (0.46) GLP1RTSHRNAMPTC3AR1EPHX2
SCHEMBL22096266 0.87 GLP1R (0.46) GLP1RTSHRNAMPTC3AR1EPHX2
SCHEMBL13699565 0.87 GLP1R (0.59) GLP1RTSHRC3AR1SIRT1SIRT6
SCHEMBL5575229 0.86 GLP1R (0.66) GLP1RC3AR1SIRT1SIRT6
SCHEMBL13699566 0.86 GLP1R (0.58) GLP1RTSHRSIRT1EPHX2SIRT6
SCHEMBL16326834 0.86 GLP1R (0.61) GLP1RSIRT1SIRT6
SCHEMBL5575211 0.86 GLP1R (0.66) GLP1RC3AR1SIRT1SIRT6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10682371-B2 Small molecule conjugates specifically activated in tumor microenvironment for targeting and use thereof YAFEI SHANGHAI BIOLOG MEDICINE SCIENCE & TECHNOLOGY CO. LTD. (CN) 2020-06-16 — — US disclosed
US-20170266308-A1 SMALL MOLECULE CONJUGATES SPECIFICALLY ACTIVATED IN TUMOR MICROENVIROMENT FOR TARGETING AND USE THEREOF YAFEI SHANGHAI BIOLOG MEDICINE SCIENCE & TECHNOLOGY CO. LTD. (CN) 2017-09-21 — — 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 (2 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-20170266308-A1 SMALL MOLECULE CONJUGATES SPECIFICALLY ACTIVATED IN TUMOR MICROENVIROMENT FOR TARGETING AND USE THEREOF CD4, MET, TNFSF10 GLP1R 4649/4885TSHR 2160/4885NAMPT 551/4885
US-10682371-B2 Small molecule conjugates specifically activated in tumor microenvironment for targeting and use thereof MET, ARG1, CD4 GLP1R 4148/4885TSHR 1479/4885NAMPT 2767/4885

“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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