SCHEMBL2598302

SCHEMBL2598302

C[Si](C)(C)CCOCn1ncc2nccc(I)c21

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 2/20 0.32
F2RL1 P55085 1/20 0.31
ATR Q13535 1/20 0.31
ATRIP Q8WXE1 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
SCHEMBL26720565 0.84 DGAT1 (0.37) DGAT1F2RL1ATRATRIP
SCHEMBL26720196 0.84 ATR (0.33) DGAT1F2RL1ATRATRIP
SCHEMBL31357963 0.77 DGAT1 (0.33) DGAT1F2RL1
SCHEMBL29626770 0.76 GRIN1 (0.34) DGAT1F2RL1
SCHEMBL2598354 0.76 GRIN1 (0.34) DGAT1F2RL1
SCHEMBL2598448 0.75 TGFBR1 (0.40)
SCHEMBL2598377 0.75 MPO (0.35)
SCHEMBL30304757 0.75 F2RL1 (0.36) DGAT1F2RL1
SCHEMBL25049226 0.74 DGAT1 (0.34) DGAT1F2RL1ATRATRIP
SCHEMBL2598357 0.73 MAPK1 (0.33)

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-2011146287-A1 PYRAZOLO[4,3-B]PYRIDINE-7-AMINE INHIBITORS OF ALK5 TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-11-24 WO disclosed