SCHEMBL4171693

SCHEMBL4171693

CC(C)(C)OC(=O)N1CCc2cc(N3CC[C@H](N)C3=O)c(Cl)cc2C1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.53
ESR2 Q92731 1/20 0.51
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39
KDM1A O60341 1/20 0.37
ADORA1 P30542 1/20 0.36
RAB9A P51151 2/20 0.36
NPC1 O15118 1/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
THRB P10828 1/20 0.36
MAPK1 P28482 1/20 0.36
GPR119 Q8TDV5 1/20 0.36
NAMPT P43490 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
IGF1R P08069 1/20 0.35
STS P08842 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PDE4B Q07343 1/20 0.35

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
SCHEMBL4178857 0.89 NR1H2 (0.54) NR1H2ESR2DDB1CRBNKDM1A
SCHEMBL4176434 0.88 NR1H2 (0.53) NR1H2ESR2DDB1CRBNKDM1A
SCHEMBL4171451 0.82 NR1H2 (0.64) NR1H2ESR2DDB1CRBNKDM1A
SCHEMBL4172281 0.82 ESR2 (0.58) NR1H2ESR2DDB1CRBNKDM1A
SCHEMBL4171919 0.82 ESR2 (0.58) NR1H2ESR2DDB1CRBNKDM1A
SCHEMBL4169066 0.79 NR1H2 (0.65) NR1H2ESR2DDB1CRBNADORA1
SCHEMBL26956128 0.79 NR1H2 (0.65) NR1H2ESR2DDB1CRBNADORA1
SCHEMBL4183601 0.77 NR1H2 (0.49) NR1H2ESR2DDB1CRBNKDM1A
SCHEMBL4638117 0.77 NR1H2 (0.54) NR1H2ESR2KDM1ARAB9ANPC1
SCHEMBL21954131 0.76 ESR2 (0.62) NR1H2ESR2NPC1MAPTKDM4E

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-20090099231-A1 3-Sulfonylamino-Pyrrolidine-2-One Derivatives as Factor Xa Inhibitors GLAXO GROUP LIMITED (GB) 2009-04-16 US disclosed
US-20090099231-A1 3-Sulfonylamino-Pyrrolidine-2-One Derivatives as Factor Xa Inhibitors GLAXO GROUP LIMITED (GB) 2009-04-16 US disclosed
US-20090099231-A1 3-Sulfonylamino-Pyrrolidine-2-One Derivatives as Factor Xa Inhibitors GLAXO GROUP LIMITED (GB) 2009-04-16 US disclosed
WO-2006108709-A1 3-SULFONYLAMINO-PYRROLIDINE-2-ONE DERIVATIVES AS FACTOR XA INHIBITORS GLAXO GROUP LIMITED (GB) 2006-10-19 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-20090099231-A1 3-Sulfonylamino-Pyrrolidine-2-One Derivatives as Factor Xa Inhibitors TFPI, SERPINC1, SERPINE1 NR1H2 3160/4885ESR2 3298/4885DDB1 4086/4885

“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.