SCHEMBL484802

SCHEMBL484802

CCCNC(=O)N1CCC2(CC1)CCN(C(=O)c1ccc3c(c1)C(N(C(=O)c1ccccc1Cl)C1CC1)CC3)C2

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.35
KMT2A Q03164 3/20 0.35
MEN1 O00255 1/20 0.35
CYP2C9 P11712 1/20 0.35
EPHX2 P34913 1/20 0.35
ENPP2 Q13822 1/20 0.34
ATXN2 Q99700 1/20 0.34
HSD11B1 P28845 3/20 0.33
CHRM4 P08173 1/20 0.33
NAMPT P43490 3/20 0.32
MTNR1B P49286 2/20 0.32
PDK2 Q15119 1/20 0.32
MTNR1A P48039 1/20 0.32
AR P10275 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32

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
SCHEMBL484822 0.90 ENPP2 (0.41) KMT2AMEN1EPHX2ENPP2ATXN2
SCHEMBL485927 0.88 HRH3 (0.40) KMT2AMEN1EPHX2ENPP2ATXN2
SCHEMBL484661 0.87 EPHX2 (0.39) CYP2C19CYP2C9EPHX2HSD11B1NAMPT
SCHEMBL486049 0.86 HSD11B1 (0.39) EPHX2HSD11B1MTNR1BPDK2MTNR1A
SCHEMBL484642 0.86 EPHX2 (0.39) EPHX2HSD11B1CNR1CNR2
SCHEMBL2818607 0.86 NAMPT (0.42) HSD11B1NAMPT
SCHEMBL485556 0.85 HSD11B1 (0.34) KMT2AEPHX2HSD11B1PDK2AR
SCHEMBL484533 0.85 EPHX2 (0.42) CYP2C19CYP2C9EPHX2NAMPT
SCHEMBL2816354 0.84 KDM4E (0.41) CYP2C19CYP2C9EPHX2
SCHEMBL484803 0.84 EPHX2 (0.43) CYP2C19EPHX2NAMPT

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 10 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 claimed
US-8455475-B2 Substituted spiro-amide compounds GRUENENTHAL GMBH (DE) 2013-06-04 US claimed
EP-2411381-A1 SUBSTITUTED SPIRO-AMIDE COMPOUNDS Grünenthal GmbH (DE) 2012-02-01 EP claimed
US-20100249095-A1 Substituted Spiro-amide Compounds GRUENENTHAL GMBH (DE) 2010-09-30 US claimed
WO-2010108651-A1 SUBSTITUTED SPIRO-AMIDE COMPOUNDS Grünenthal GmbH (DE) 2010-09-30 WO claimed
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 CYP2C19 2325/4885KMT2A 2136/4885MEN1 901/4885
US-20100249095-A1 Substituted Spiro-amide Compounds BDKRB1, BDKRB2, REN CYP2C19 2325/4885KMT2A 2136/4885MEN1 901/4885

“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.