SCHEMBL8201517

SCHEMBL8201517

CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)NC2c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.47
NR1H2 P55055 3/20 0.45
RXRA P19793 2/20 0.45
NR1H3 Q13133 2/20 0.45
AGTR2 P50052 1/20 0.45
TSHR P16473 2/20 0.44
ALOX15 P16050 1/20 0.44
ATM Q13315 1/20 0.44
BACE1 P56817 3/20 0.44
CCR5 P51681 2/20 0.43
KDM4E B2RXH2 1/20 0.43
PKM P14618 1/20 0.43
KDM1A O60341 1/20 0.43
USP30 Q70CQ3 1/20 0.43
RORC P51449 2/20 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
SCHEMBL12492338 0.88 MEN1 (0.43) KDM4ERORC
SCHEMBL3987027 0.88 MEN1 (0.48) KDM4E
SCHEMBL8204443 0.87 GPR119 (0.50) GPR119KDM4EKDM1A
SCHEMBL14058424 0.86 USP30 (0.42) GPR119NR1H2RXRANR1H3BACE1
SCHEMBL8207921 0.83 GPR119 (0.49) GPR119TSHRCCR5KDM1AUSP30
SCHEMBL4334410 0.81 SLC6A9 (0.53)
SCHEMBL14263430 0.80 AGTR2 (0.49) AGTR2
SCHEMBL8218920 0.80 GPR119 (0.48) GPR119TSHRALOX15ATMBACE1
SCHEMBL8218899 0.80 GPR119 (0.48) GPR119NR1H2RXRANR1H3TSHR
SCHEMBL13026389 0.79 USP30 (0.46) GPR119NR1H2RXRANR1H3TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10370388-B2 Heterocyclic compounds and methods of their use NOVARTIS AG (CH) 2019-08-06 US disclosed
US-20170145032-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF THEIR USE SPINIFEX PHARMACEUTICALS PTY LTD (AU) 2017-05-25 US disclosed
US-9624243-B2 Heterocyclic compounds and methods of their use NOVARTIS AG (CH) 2017-04-18 US disclosed
US-20140378430-A1 Heterocyclic Compounds and Methods of Their Use SPINIFEX PHARMACEUTICALS PTY LTD (AU) 2014-12-25 US disclosed
US-20080076750-A1 Azetidinone Derivatives and Methods of Use Thereof SCHERING CORPORATION 2008-03-27 US disclosed
US-20080076750-A1 Azetidinone Derivatives and Methods of Use Thereof SCHERING CORPORATION 2008-03-27 US disclosed
WO-2008033460-A2 TREATING PAIN, DIABETES, AND LIPID METABOLISM DISORDERS SCHERING CORPORATION (US) 2008-03-20 WO disclosed
WO-2008033465-A1 AZETIDINONE DERIVATIVES AND METHODS OF USE THEREOF SCHERING CORPORATION (US) 2008-03-20 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 (4 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-20080076750-A1 Azetidinone Derivatives and Methods of Use Thereof LIPC, CES1, ZDHHC20 GPR119 81/4885NR1H2 36/4885RXRA 706/4885
US-10370388-B2 Heterocyclic compounds and methods of their use AGTR2, AGTR1, BDKRB2 GPR119 306/4885NR1H2 2137/4885RXRA 2992/4885
US-20140378430-A1 Heterocyclic Compounds and Methods of Their Use AGTR2, AGTR1, BDKRB2 GPR119 314/4885NR1H2 2125/4885RXRA 3003/4885
US-20170145032-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF THEIR USE AGTR2, AGTR1, BDKRB2 GPR119 314/4885NR1H2 2125/4885RXRA 3003/4885

“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.