SCHEMBL19409592

SCHEMBL19409592

COC(=O)Cc1ccc(OCC2CCN(C(=O)OC(C)(C)C)CC2)c(F)c1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.48
GPR119 Q8TDV5 10/20 0.46
RBP4 P02753 1/20 0.45
KDM4E B2RXH2 1/20 0.44
PKM P14618 1/20 0.44
HDAC1 Q13547 1/20 0.43
YAP1 P46937 1/20 0.43
SLC2A1 P11166 1/20 0.42
ALOX5AP P20292 1/20 0.42
FEN1 P39748 1/20 0.42

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
SCHEMBL19409668 0.90 GPR119 (0.48) SCN9AGPR119RBP4KDM4EPKM
SCHEMBL19409514 0.86 GPR119 (0.48) SCN9AGPR119RBP4KDM4EPKM
SCHEMBL15537604 0.83 GPR119 (0.50) SCN9AGPR119KDM4EPKMALOX5AP
SCHEMBL13419698 0.83 GPR119 (0.50) SCN9AGPR119KDM4EPKMALOX5AP
SCHEMBL25379718 0.82 GPR119 (0.53) GPR119KDM4E
SCHEMBL31330761 0.81 RBP4 (0.58) SCN9AGPR119RBP4ALOX5APFEN1
SCHEMBL16777273 0.80 GPR119 (0.51) SCN9AGPR119ALOX5APFEN1
SCHEMBL22265766 0.80 KDM4E (0.54) SCN9AGPR119KDM4EPKMALOX5AP
SCHEMBL5213121 0.79 TLR7 (0.51) SCN9AGPR119KDM4EPKM
SCHEMBL13419611 0.79 ALDH1A1 (0.50) SCN9AGPR119ALOX5APFEN1

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
EP-3436444-B1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2020-05-13 EP disclosed
US-10323026-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-06-18 US disclosed
EP-3436444-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2019-02-06 EP disclosed
WO-2017171100-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-10-05 WO disclosed
US-20170283406-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-10-05 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 (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-20170283406-A1 HETEROCYCLIC COMPOUND MAG, HTT, ACHE SCN9A 499/4885GPR119 2126/4885RBP4 4767/4885
US-10323026-B2 Heterocyclic compound MAG, HTT, ACHE SCN9A 499/4885GPR119 2126/4885RBP4 4767/4885

“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.