SCHEMBL16631575

SCHEMBL16631575

C[C@H]1O[C@@H](c2cnc(=O)[nH]c2F)[C@@H](O)C1O

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
PMP22 Q01453 1/20 0.37
HBB P68871 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
SELP P16109 4/20 0.36
SELL P14151 2/20 0.36

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
SCHEMBL16631425 0.89 TSHR (0.33) TSHRLMNAMAPTPMP22HBB
SCHEMBL16631290 0.85 TSHR (0.32) TSHRLMNAMAPTPMP22HBB
SCHEMBL16631570 0.81 PYGL (0.44) TSHRLMNAMAPTPMP22SMN1; SMN2
SCHEMBL16631578 0.81 SELP (0.32) TSHRLMNAMAPTPMP22HBB
SCHEMBL16631190 0.77 TSHR (0.40) TSHRLMNAMAPTPMP22HBB
SCHEMBL16631503 0.73 PYGL (0.38) LMNAMAPTPMP22SMN1; SMN2
SCHEMBL16631377 0.72 PNP (0.36) TSHRLMNAMAPT
SCHEMBL16631258 0.68 TSHR (0.33) TSHRLMNAMAPTPMP22HBB
SCHEMBL16631516 0.67 PYGL (0.44) TSHRLMNAMAPTPMP22SMN1; SMN2
SCHEMBL16631724 0.65 LMNA (0.42) TSHRLMNAPMP22SMN1; SMN2

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-2015051173-A2 POLYNUCLEOTIDE MOLECULES AND USES THEREOF MODERNA THERAPEUTICS, INC (US) 2015-04-09 WO disclosed