SCHEMBL3738709

SCHEMBL3738709

CC(C)(C)OC(=O)N1C(=O)CCC1c1cccc(O)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 2/20 0.40
KIF11 P52732 5/20 0.40
PRKCZ Q05513 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ESR1 P03372 1/20 0.38
GPR119 Q8TDV5 1/20 0.37
RIPK1 Q13546 2/20 0.36
OPRK1 P41145 1/20 0.36
POLB P06746 1/20 0.36
CASP3 P42574 1/20 0.36
KCNH2 Q12809 1/20 0.36
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 1/20 0.36
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36

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
SCHEMBL7589379 0.86 L3MBTL1 (0.51) L3MBTL1GPR119RIPK1NR1H2NR1H3
SCHEMBL27773399 0.85 POLB (0.41) POLB
SCHEMBL3495689 0.79 PDE4B (0.44) DDB1CRBN
SCHEMBL27528621 0.79 RORC (0.46) PRKCZL3MBTL1DDB1CRBNNR1H2
SCHEMBL29779454 0.79 RORC (0.46) PRKCZL3MBTL1DDB1CRBNNR1H2
SCHEMBL29779329 0.79 RORC (0.46) PRKCZL3MBTL1DDB1CRBNNR1H2
SCHEMBL22039428 0.79 HTR7 (0.42) PRKCZL3MBTL1DDB1CRBN
SCHEMBL7236411 0.79 HTR7 (0.42) PRKCZL3MBTL1DDB1CRBN
SCHEMBL23646533 0.77 RIPK1 (0.50) RIPK1NR1H2NR1H3
SCHEMBL21611363 0.77 RIPK1 (0.50) RIPK1NR1H2NR1H3

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-8242285-B2 N-tert-butoxycarbonyl-2-pyrrolidinones and production method thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-14 US disclosed
US-20100280259-A1 N-Tert-Butoxycarbonyl-2-Pyrrolidinones and Production Method Thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-11-04 US disclosed
US-20090163722-A1 N-TERT-BUTOXYCARBONYL-2-PYRROLIDINONES AND PRODUCTION METHOD THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-06-25 US disclosed
CN-101415676-A N-tert-butoxycarbonyl-2-pyrrolidinone compounds and method for producing the same SUMITOMO CHEMICAL CO (JP) 2009-04-22 CN disclosed
EP-2008999-A1 N-TERT-BUTOXYCARBONYL-2-PYRROLIDINONES AND PROCESS FOR PRODUCING THE SAME Sumitomo Chemical Company, Limited (JP) 2008-12-31 EP 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-20090163722-A1 N-TERT-BUTOXYCARBONYL-2-PYRROLIDINONES AND PRODUCTION METHOD THEREOF TERT, CBR1, TELO2 ESR2 1362/4885KIF11 3487/4885PRKCZ 2618/4885
US-20100280259-A1 N-Tert-Butoxycarbonyl-2-Pyrrolidinones and Production Method Thereof TERT, CBR1, TELO2 ESR2 1362/4885KIF11 3487/4885PRKCZ 2618/4885

“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.