SCHEMBL4263116

SCHEMBL4263116

CC(NC(=O)N1CCc2onc(C(=O)NCc3ccccc3)c2C1)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.56
KMT2A Q03164 2/20 0.56
RAB9A P51151 3/20 0.55
HPGD P15428 2/20 0.55
NPC1 O15118 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
ALDH1A1 P00352 6/20 0.53
MAPK1 P28482 1/20 0.53
GAA P10253 3/20 0.47
HSP90AA1 P07900 4/20 0.46
MAPT P10636 1/20 0.46
TSHR P16473 1/20 0.46
ATM Q13315 1/20 0.45
ACACB O00763 1/20 0.43

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
SCHEMBL2585095 0.82 ALDH1A1 (0.55) LMNAKMT2ARAB9AHPGDNPC1
SCHEMBL2580961 0.81 ALDH1A1 (0.65) LMNARAB9ANPC1SMN1; SMN2ALDH1A1
SCHEMBL4263699 0.79 MAPT (0.60) LMNAKMT2ARAB9AHPGDNPC1
SCHEMBL4267373 0.77 ALDH1A1 (0.53) LMNAKMT2ARAB9ANPC1SMN1; SMN2
SCHEMBL2588184 0.76 MAPT (0.63) LMNAKMT2ARAB9AHPGDNPC1
SCHEMBL2584766 0.74 KMT2A (0.44) LMNAKMT2ARAB9AHPGDNPC1
SCHEMBL13545783 0.73 KMT2A (1.00) LMNAKMT2ARAB9AHPGDNPC1
SCHEMBL2580660 0.72 ALDH1A1 (0.60) LMNAKMT2ARAB9AHPGDNPC1
SCHEMBL2579076 0.71 GAA (0.55) LMNAKMT2ARAB9AHPGDNPC1
SCHEMBL14140710 0.71 ALDH1A1 (0.98) LMNAKMT2ARAB9AHPGDNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
EP-1869053-A1 SUBSTITUTED 4,5,6,7-TETRAHYDRO-ISOXAZOLO[4,5-C]PYRIDINE COMPOUNDS AND THEIR USE IN THE PRODUCTION OF MEDICAMENTS Grünenthal GmbH (DE) 2007-12-26 EP claimed
WO-2006105945-A1 SUBSTITUTED 4,5,6,7-TETRAHYDRO-ISOXAZOLO[4,5-C]PYRIDINE COMPOUNDS AND THEIR USE IN THE PRODUCTION OF MEDICAMENTS Grünenthal GmbH (DE) 2006-10-12 WO claimed
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 (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-20090076001-A1 Substituted 4,5,6,7 -Tetrahydro-Isoxazolo[4,5-C]Pyridine Compounds and Use Thereof for Producing Medicaments P2RX5, P2RX4, P2RX7 LMNA 2302/4885KMT2A 4073/4885RAB9A 4445/4885

“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.