SCHEMBL19205324

SCHEMBL19205324

CC(C)(C)OC(=O)N1CC[C@H](COc2ccccc2C2CCC2)C1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 4/20 0.56
FEN1 P39748 4/20 0.56
RBP4 P02753 4/20 0.53
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
SCN9A Q15858 1/20 0.47
GPR119 Q8TDV5 2/20 0.46
SSTR1 P30872 1/20 0.45
SSTR4 P31391 1/20 0.45
PDE4B Q07343 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.44
BCHE P06276 1/20 0.44
HTR6 P50406 1/20 0.44

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
SCHEMBL19205323 1.00 ALOX5AP (0.56) ALOX5APFEN1RBP4KDM4EPKM
SCHEMBL19205332 0.98 ALOX5AP (0.54) ALOX5APFEN1RBP4KDM4EPKM
SCHEMBL19205333 0.98 ALOX5AP (0.54) ALOX5APFEN1RBP4KDM4EPKM
SCHEMBL19205402 0.98 ALOX5AP (0.54) ALOX5APFEN1RBP4KDM4EPKM
SCHEMBL19205390 0.97 RBP4 (0.54) ALOX5APFEN1RBP4KDM4EPKM
SCHEMBL19205388 0.97 RBP4 (0.54) ALOX5APFEN1RBP4KDM4EPKM
SCHEMBL19205404 0.86 RBP4 (0.56) ALOX5APFEN1RBP4SCN9AGPR119
SCHEMBL19205428 0.85 RBP4 (0.57) RBP4SSTR1SSTR4MEN1KMT2A
SCHEMBL20744476 0.84 RBP4 (0.54) ALOX5APFEN1RBP4KDM4EPKM
SCHEMBL27157756 0.84 RBP4 (0.54) ALOX5APFEN1RBP4KDM4EPKM

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
EP-3210971-B1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2019-10-16 EP disclosed
US-9944596-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-04-17 US disclosed
US-9944596-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-04-17 US disclosed
US-9944596-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-04-17 US disclosed
EP-3210971-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2017-08-30 EP disclosed
US-20170233339-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-08-17 US disclosed
US-20170233339-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-08-17 US disclosed
US-20170233339-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-08-17 US 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-20170233339-A1 HETEROCYCLIC COMPOUND RBP4, RBP1, RARA ALOX5AP 2617/4885FEN1 3383/4885RBP4 1/4885

“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.