SCHEMBL15503351

SCHEMBL15503351

CCC(=O)C1C(C)CCCN1C(=O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PREP P48147 3/20 0.52
ACE2 Q9BYF1 2/20 0.51
TSHR P16473 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
KDM4E B2RXH2 1/20 0.51
LMNA P02545 1/20 0.51
NPSR1 Q6W5P4 1/20 0.49
PRCP P42785 1/20 0.48
GFER P55789 1/20 0.48

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
SCHEMBL221540 0.89 PREP (0.55) PREPACE2TSHRL3MBTL1KDM4E
SCHEMBL221538 0.89 PREP (0.55) PREPACE2TSHRL3MBTL1KDM4E
SCHEMBL221539 0.89 PREP (0.55) PREPACE2TSHRL3MBTL1KDM4E
SCHEMBL2737914 0.86 PREP (0.49) PREPACE2TSHRL3MBTL1KDM4E
SCHEMBL2737913 0.86 PREP (0.54) PREPACE2TSHRL3MBTL1KDM4E
SCHEMBL13389110 0.84 TSHR (0.65) PREPTSHRL3MBTL1KDM4ELMNA
SCHEMBL29302839 0.82 SMN1; SMN2 (0.48) PREPACE2
SCHEMBL29302833 0.82 SMN1; SMN2 (0.48) PREPACE2
SCHEMBL17009197 0.81 PREP (0.55) PREPACE2TSHRL3MBTL1KDM4E
SCHEMBL16282507 0.81 PREP (0.55) PREPACE2TSHRL3MBTL1KDM4E

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-20160130275-A1 PYRAZOLO[1,5-A]PYRIMIDINES FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. 2016-05-12 US disclosed
US-20140072554-A1 PYRAZOLO[1,5-A]PYRIMIDINES FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2014-03-13 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-20140072554-A1 PYRAZOLO[1,5-A]PYRIMIDINES FOR ANTIVIRAL TREATMENT TYMP, ZC3HAV1, TYMS PREP 672/4885ACE2 22/4885TSHR 3983/4885
US-20160130275-A1 PYRAZOLO[1,5-A]PYRIMIDINES FOR ANTIVIRAL TREATMENT TYMP, ZC3HAV1, TYMS PREP 672/4885ACE2 22/4885TSHR 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.