SCHEMBL484881

SCHEMBL484881

O=C(O)N1CCC2(CCN(c3ncccn3)CC2)C1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.66
KMT2A Q03164 1/20 0.66
CYP3A4 P08684 10/20 0.61
CYP2D6 P10635 9/20 0.59
CYP2C9 P11712 8/20 0.59
CYP1A2 P05177 6/20 0.59
CYP2C19 P33261 6/20 0.59
ALDH1A1 P00352 6/20 0.59
SMN1; SMN2 Q16637 5/20 0.59
MAPK1 P28482 3/20 0.59
HSD17B10 Q99714 8/20 0.58
HPGD P15428 3/20 0.55
USP2 O75604 3/20 0.54
TSHR P16473 2/20 0.53
HIF1A Q16665 1/20 0.53

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
SCHEMBL484476 0.82 HSD17B10 (0.69) CYP3A4CYP2D6CYP2C9CYP1A2CYP2C19
SCHEMBL484575 0.80 USP2 (0.52) MEN1KMT2ACYP3A4CYP2D6CYP2C9
SCHEMBL485352 0.79 CYP3A4 (0.62) MEN1KMT2ACYP3A4CYP2D6CYP2C9
SCHEMBL2856220 0.78 GAA (0.61) MEN1KMT2ACYP2C19ALDH1A1HSD17B10
SCHEMBL640636 0.77 ITGB3 (0.67) MEN1KMT2ACYP3A4CYP2D6CYP2C9
SCHEMBL484770 0.76 CYP3A4 (0.54) MEN1KMT2ACYP3A4CYP2D6CYP2C9
SCHEMBL29418104 0.75 HSD11B1 (0.42) CYP3A4CYP2C19ALDH1A1MAPK1USP2
SCHEMBL14996534 0.75 CYP3A4 (0.59) MEN1KMT2ACYP3A4CYP2D6CYP2C9
SCHEMBL27226753 0.74 HSD17B10 (0.40) MEN1KMT2ACYP3A4CYP2D6CYP2C9
SCHEMBL15416130 0.73 MEN1 (0.55) MEN1KMT2ACYP3A4CYP2D6CYP2C9

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-20130231327-A1 Substituted Spiro-Amide Compounds GRUENENTHAL GMBH (DE) 2013-09-05 US disclosed
US-8455475-B2 Substituted spiro-amide compounds GRUENENTHAL GMBH (DE) 2013-06-04 US disclosed
EP-2411381-A1 SUBSTITUTED SPIRO-AMIDE COMPOUNDS Grünenthal GmbH (DE) 2012-02-01 EP disclosed
US-20100249095-A1 Substituted Spiro-amide Compounds GRUENENTHAL GMBH (DE) 2010-09-30 US disclosed
WO-2010108651-A1 SUBSTITUTED SPIRO-AMIDE COMPOUNDS Grünenthal GmbH (DE) 2010-09-30 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 (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-20130231327-A1 Substituted Spiro-Amide Compounds BDKRB1, BDKRB2, REN MEN1 901/4885KMT2A 2136/4885CYP3A4 3781/4885
US-20100249095-A1 Substituted Spiro-amide Compounds BDKRB1, BDKRB2, REN MEN1 901/4885KMT2A 2136/4885CYP3A4 3781/4885

“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.