SCHEMBL20723197

SCHEMBL20723197

Cc1nn2c(C(C)C)cc(C(=O)NCC(=O)O)nc2c1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GLA P06280 1/20 0.47
▸ MAPT P10636 8/20 0.47
▸ KDM4E B2RXH2 7/20 0.47
▸ NPSR1 Q6W5P4 4/20 0.47
▸ MAPK1 P28482 2/20 0.47
▸ HSP90AA1 P07900 1/20 0.47
▸ ALDH1A1 P00352 5/20 0.45
▸ HPGD P15428 2/20 0.45
▸ LMNA P02545 2/20 0.45
▸ TDP1 Q9NUW8 2/20 0.45
▸ HTT P42858 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ PI4KB Q9UBF8 1/20 0.43
▸ THRB P10828 1/20 0.42

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
SCHEMBL20723257 0.89 NPSR1 (0.53) MAPTKDM4ENPSR1MAPK1HSP90AA1
SCHEMBL20723212 0.87 KDM4E (0.50) GLAMAPTKDM4ENPSR1MAPK1
SCHEMBL20722928 0.84 KDM4E (0.51) GLAMAPTKDM4ENPSR1MAPK1
SCHEMBL20723210 0.83 GLA (0.48) GLAMAPTKDM4ENPSR1MAPK1
SCHEMBL24923398 0.83 GLA (0.55) GLAMAPTKDM4ENPSR1MAPK1
SCHEMBL20722880 0.82 KDM4E (0.52) GLAMAPTKDM4ENPSR1MAPK1
SCHEMBL20723149 0.81 MAPT (0.54) GLAMAPTKDM4ENPSR1MAPK1
SCHEMBL20723228 0.80 KDM4E (0.48) GLAMAPTKDM4ENPSR1MAPK1
SCHEMBL20722905 0.76 MAPT (0.43) GLAMAPTKDM4ENPSR1MAPK1
SCHEMBL20722940 0.76 MAPT (0.43) GLAMAPTKDM4ENPSR1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230037225-A1 SUBSTITUTED PYRAZOLO[1,5-a]PYRIMIDINES AS APELIN RECEPTOR AGONISTS Sanford Burnham Prebys Medical Discovery Institute 2023-02-02 — — US disclosed
US-11345705-B2 Substituted pyrazolo[1,5-a]pyrimidines as apelin receptor agonists Sanford Burnham Prebys Medical Discovery Institute (US) 2022-05-31 — — US disclosed
US-20210040098-A1 APELIN RECEPTOR AGONISTS AND METHODS OF USE THEREOF Sanford Burnham Prebys Medical Discovery Institute 2021-02-11 — — US disclosed
EP-3664806-A1 APELIN RECEPTOR AGONISTS AND METHODS OF USE THEREOF Sanford Burnham Prebys Medical Discovery Institute (US) 2020-06-17 — — EP disclosed
WO-2019032720-A1 APELIN RECEPTOR AGONISTS AND METHODS OF USE THEREOF Sanford Burnham Prebys Medical Discovery Institute (US) 2019-02-14 — — WO disclosed
WO-2019032720-A1 APELIN RECEPTOR AGONISTS AND METHODS OF USE THEREOF Sanford Burnham Prebys Medical Discovery Institute (US) 2019-02-14 — — 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 (3 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-11345705-B2 Substituted pyrazolo[1,5-a]pyrimidines as apelin receptor agonists APLNR, AP3B1, AGTR1 GLA 3279/4885MAPT 3809/4885KDM4E 4400/4885
US-20210040098-A1 APELIN RECEPTOR AGONISTS AND METHODS OF USE THEREOF APLNR, APMAP, EDNRA GLA 1991/4885MAPT 4138/4885KDM4E 4688/4885
US-20230037225-A1 SUBSTITUTED PYRAZOLO[1,5-a]PYRIMIDINES AS APELIN RECEPTOR AGONISTS APLNR, AP3B1, AGTR1 GLA 3279/4885MAPT 3809/4885KDM4E 4400/4885

“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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