SCHEMBL10273089

SCHEMBL10273089

CC(C)c1cc2c(cc1C(C)(C)C)OCCO2

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.34
PTGS2 P35354 2/20 0.34
HSP90AA1 P07900 1/20 0.33
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TRPV1 Q8NER1 1/20 0.31
ALDH1A1 P00352 2/20 0.30
MAPT P10636 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30
ALOX5 P09917 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL23480218 0.89 CYP3A4 (0.36) MEN1KMT2ATRPV1ALDH1A1MAPT
SCHEMBL12424584 0.81 PTGS1 (0.41) PTGS1PTGS2HSP90AA1KDM4EMEN1
SCHEMBL6365029 0.81 ITGB2 (0.38) PTGS1PTGS2KDM4EPOLBHSD17B10
SCHEMBL24910485 0.76 TSHR (0.46)
SCHEMBL19934178 0.75 MAPT (0.45) PTGS1PTGS2HSP90AA1KDM4EKMT2A
SCHEMBL16843333 0.74 GPR3 (0.33)
SCHEMBL22792869 0.74
SCHEMBL18680385 0.74 ALDH1A1 (0.38) PTGS1PTGS2HSP90AA1KDM4EMEN1
SCHEMBL13341067 0.72 ALDH1A1 (0.45) PTGS1PTGS2HSP90AA1KDM4EMEN1
SCHEMBL15979635 0.72 HSP90AA1 (0.50) PTGS1PTGS2HSP90AA1ALOX5LMNA

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-20230331734-A1 NOVEL SPIROPYRROLIDINE DERIVED ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2023-10-19 US disclosed
US-20230159546-A1 NOVEL SPIROPYRROLIDINE DERIVED ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2023-05-25 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-20230331734-A1 NOVEL SPIROPYRROLIDINE DERIVED ANTIVIRAL AGENTS ACE, PKD1, ACE2 PTGS1 1006/4885PTGS2 2762/4885HSP90AA1 1176/4885
US-20230159546-A1 NOVEL SPIROPYRROLIDINE DERIVED ANTIVIRAL AGENTS ACE, ACE2, REN PTGS1 643/4885PTGS2 2027/4885HSP90AA1 2142/4885

“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.