Sugi Predict

Sugi Predict / Compounds / SCHEMBL9058124

SCHEMBL9058124

SCHEMBL9058124

CSCCOC(=O)c1cccc(NC(=O)N[C@@H]2N=C(c3ccccc3F)c3ccccc3N(CC(=O)N3CC4CCC(CC4)C3)C2=O)c1

nearest known ligand 0.73

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ CCKBR P32239 17/20 0.73
▸ CCKAR P32238 1/20 0.47

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
SCHEMBL9058119 1.00 CCKBR (0.73) CCKBRCCKAR
SCHEMBL9054170 0.91 CCKBR (0.81) CCKBRCCKAR
SCHEMBL9058072 0.90 CCKBR (0.75) CCKBRCCKAR
SCHEMBL9058078 0.90 CCKBR (0.75) CCKBRCCKAR
SCHEMBL8775033 0.88 CCKBR (0.77) CCKBR
SCHEMBL9054748 0.87 CCKBR (0.84) CCKBRCCKAR
SCHEMBL8774072 0.87 CCKBR (0.84) CCKBRCCKAR
SCHEMBL9057154 0.87 CCKBR (0.84) CCKBRCCKAR
SCHEMBL9054840 0.86 CCKBR (0.85) CCKBRCCKAR
SCHEMBL9054598 0.85 CCKBR (0.84) CCKBRCCKAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996004254-A2 BENZODIAZEPINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-02-15 — — WO disclosed