SCHEMBL16856789

SCHEMBL16856789

O=C1Nc2ccnc(N3CCOCC3)c2CN1c1cc2c(cc1Cl)CCC(c1ncccc1F)O2

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SNRNP200 O75643 3/20 0.51
IDH1 O75874 9/20 0.34
SLC8A1 P32418 1/20 0.33
NR1I2 O75469 1/20 0.33
TDO2 P48775 1/20 0.32
AKT1 P31749 3/20 0.32
MALT1 Q9UDY8 2/20 0.31
GRIA1 P42261 1/20 0.31

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
SCHEMBL16857040 0.88 SNRNP200 (0.56) SNRNP200
SCHEMBL15592758 0.88 SNRNP200 (0.56) SNRNP200
SCHEMBL16856880 0.88 SNRNP200 (0.56) SNRNP200
SCHEMBL16857334 0.88 SNRNP200 (0.47) SNRNP200IDH1SLC8A1NR1I2AKT1
SCHEMBL15592841 0.87 SNRNP200 (0.55) SNRNP200
SCHEMBL16856827 0.86 SNRNP200 (0.49) SNRNP200IDH1NR1I2AKT1
SCHEMBL16857216 0.84 SNRNP200 (0.54) SNRNP200
SCHEMBL16857182 0.83 SNRNP200 (0.52) SNRNP200IDH1
SCHEMBL16857308 0.83 SNRNP200 (0.55) SNRNP200IDH1
SCHEMBL16856997 0.82 SNRNP200 (0.55) SNRNP200IDH1

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-20150299188-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-10-22 US disclosed
US-20150299188-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-10-22 US disclosed
US-20150299188-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-10-22 US disclosed
EP-2889291-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2015-07-01 EP disclosed
EP-2889291-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2015-07-01 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 (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-20150299188-A1 HETEROCYCLIC COMPOUND PTGIS, LIPG, FEN1 SNRNP200 3216/4885IDH1 3193/4885SLC8A1 1449/4885

“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.