SCHEMBL4574391

SCHEMBL4574391

Cc1nc2c3c(c(C(=O)O)cn2c1C)CCC1(CCc2cc(F)ccc21)O3

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL4574083 0.89 TSHR (0.40) MEN1KMT2A
SCHEMBL4574395 0.87 HCAR2 (0.35)
SCHEMBL4574534 0.81 CYP3A4 (0.31)
SCHEMBL4575118 0.77 HCRTR1 (0.30)
SCHEMBL4574346 0.76 HTT (0.34) MEN1KMT2A
SCHEMBL4596912 0.76 LMNA (0.35) MEN1KMT2A
SCHEMBL4597065 0.76 HCRTR1 (0.33)
SCHEMBL4595427 0.76 LMNA (0.35) MEN1KMT2A
SCHEMBL4573882 0.76 SMN1; SMN2 (0.34) MEN1KMT2A
SCHEMBL5566503 0.72 SPR (0.32)

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-2008071766-A2 SPIRO-INDENE SUBSTITUTED IMIDAZONAPHYTHYRIDINE AND PYRANOIMIDAZOPYRIDINE DERIVATIVES AS INHIBITORS OF GASTRIC ACID SECRETION NYCOMED GMBH (DE) 2008-06-19 WO disclosed