SCHEMBL16857094

SCHEMBL16857094

CNC(=O)c1cc2c(c(C3CC3)n1)CN(c1cc3c(cc1Cl)CCC(c1ncccc1F)O3)C(=O)N2

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SNRNP200 O75643 3/20 0.50
PARP1 P09874 1/20 0.32
IP6K1 Q92551 1/20 0.32
TPH1 P17752 1/20 0.32
PDE2A O00408 2/20 0.31
PDE10A Q9Y233 2/20 0.31
RIPK1 Q13546 1/20 0.30

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
SCHEMBL16856972 0.93 SNRNP200 (0.48) SNRNP200
SCHEMBL16857237 0.92 SNRNP200 (0.51) SNRNP200
SCHEMBL16857452 0.92 SNRNP200 (0.52) SNRNP200
SCHEMBL16857178 0.91 SNRNP200 (0.48) SNRNP200
SCHEMBL16856885 0.91 SNRNP200 (0.50) SNRNP200
SCHEMBL16857295 0.91 SNRNP200 (0.50) SNRNP200PDE10A
SCHEMBL16857149 0.91 SNRNP200 (0.47) SNRNP200
SCHEMBL16857102 0.90 SNRNP200 (0.50) SNRNP200TPH1
SCHEMBL16857342 0.90 SNRNP200 (0.48) SNRNP200IP6K1
SCHEMBL16856888 0.90 SNRNP200 (0.52) SNRNP200IP6K1

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 3216/4885PARP1 473/4885IP6K1 1126/4885

“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.