SCHEMBL8252594

SCHEMBL8252594

CC(C)(C)OC(=O)N1CCC(B2OC(C)(C)C(C)(C)O2)=C(C(=O)O)C1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ADORA1 P30542 2/20 0.42
▸ ESR2 Q92731 1/20 0.40
▸ NR1H2 P55055 3/20 0.39
▸ USP30 Q70CQ3 1/20 0.39
▸ USP2 O75604 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ MAPT P10636 3/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ FABP4 P15090 1/20 0.34
▸ FABP5 Q01469 1/20 0.34
▸ HPGD P15428 1/20 0.33
▸ PARP1 P09874 1/20 0.33
▸ TNKS2 Q9H2K2 1/20 0.33
▸ PARP2 Q9UGN5 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ PDK4 Q16654 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
SCHEMBL1081654 0.85 ADORA1 (0.47) ADORA1ESR2NR1H2USP30USP2
SCHEMBL25305107 0.85 ESR2 (0.44) ADORA1ESR2NR1H2USP30USP2
SCHEMBL30965884 0.84 ESR2 (0.41) ADORA1ESR2NR1H2USP30USP2
SCHEMBL30340772 0.84 TSHR (0.36) SMN1; SMN2MAPTALDH1A1LMNAMAPK1
SCHEMBL11981955 0.82 NR1H2 (0.41) ADORA1ESR2NR1H2USP30USP2
SCHEMBL2483591 0.78 ADORA1 (0.47) ADORA1ESR2NR1H2USP30USP2
SCHEMBL29023102 0.74 USP30 (0.37) ESR2NR1H2USP30USP2SMN1; SMN2
SCHEMBL22204312 0.74 PARP1 (0.41) ADORA1ESR2NR1H2USP30MAPT
SCHEMBL30340769 0.74 TSHR (0.36) SMN1; SMN2MAPTALDH1A1LMNAMAPK1
SCHEMBL2118147 0.74 ESR2 (0.46) ADORA1ESR2NR1H2USP30MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090137566-A1 Substituted Piperdines as Renin Inhibitors EHARA TAKERU 2009-05-28 — — US disclosed
US-20090137566-A1 Substituted Piperdines as Renin Inhibitors EHARA TAKERU 2009-05-28 — — US disclosed
WO-2006125621-A1 SUBSTITUTED PIPERIDINES AS RENIN INHIBITORS NOVARTIS AG (CH) 2006-11-30 — — 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 (1 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-20090137566-A1 Substituted Piperdines as Renin Inhibitors REN, ACE, AGTR1 ADORA1 155/4885ESR2 2484/4885NR1H2 2535/4885

“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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