SCHEMBL2587066

SCHEMBL2587066

CN(C(=O)c1noc2c1CN(C(=O)OC(C)(C)C)CC2)C1CC1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
GPR119 Q8TDV5 14/20 0.40
USP30 Q70CQ3 1/20 0.39
HSP90AA1 P07900 2/20 0.38
MAPT P10636 1/20 0.37

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
SCHEMBL5531337 0.83 USP2 (0.38) USP2ALDH1A1POLBGPR119HSP90AA1
SCHEMBL2576275 0.82 ADORA1 (0.46) USP2ALDH1A1POLBHSP90AA1MAPT
SCHEMBL22481977 0.82 USP2 (0.42) USP2ALDH1A1POLBHSP90AA1MAPT
SCHEMBL22615316 0.80 SMN1; SMN2 (0.55) USP2ALDH1A1POLBUSP30HSP90AA1
SCHEMBL22615425 0.79 HSP90AA1 (0.37) USP2ALDH1A1POLBUSP30HSP90AA1
SCHEMBL22621730 0.79 HSP90AA1 (0.43) USP2ALDH1A1POLBHSP90AA1
SCHEMBL3441391 0.78 KMT2A (0.57) USP2ALDH1A1POLBHSP90AA1MAPT
SCHEMBL2587065 0.77 KDM4E (0.47) USP2ALDH1A1POLBHSP90AA1
SCHEMBL2582147 0.77 HSP90AA1 (0.58) USP2ALDH1A1POLBHSP90AA1MAPT
SCHEMBL16217172 0.77 ESR2 (0.43) USP2ALDH1A1POLBGPR119HSP90AA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220306647-A1 NOVEL INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITUS B VIRUS (HBV) AICURIS GMBH & CO. KG (DE) 2022-09-29 US disclosed
EP-3962914-A1 NOVEL INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AiCuris GmbH & Co. KG (DE) 2022-03-09 EP disclosed
WO-2020221826-A1 NOVEL INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AICURIS GMBH & CO. KG (DE) 2020-11-05 WO disclosed
US-8048879-B2 Substituted 4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyridine compounds and use thereof for producing medicaments GRUENENTHAL GMBH (DE) 2011-11-01 US disclosed
US-20090076001-A1 Substituted 4,5,6,7 -Tetrahydro-Isoxazolo[4,5-C]Pyridine Compounds and Use Thereof for Producing Medicaments GRUENENTHAL GMBH (DE) 2009-03-19 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-20090076001-A1 Substituted 4,5,6,7 -Tetrahydro-Isoxazolo[4,5-C]Pyridine Compounds and Use Thereof for Producing Medicaments P2RX5, P2RX4, P2RX7 USP2 3751/4885ALDH1A1 1107/4885POLB 4291/4885
US-20220306647-A1 NOVEL INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITUS B VIRUS (HBV) HCCS, IDO1, BRD4 USP2 416/4885ALDH1A1 3923/4885POLB 422/4885

“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.