SCHEMBL23329909

SCHEMBL23329909

CCCCCCCN(C)c1nc(NC2COC2)cc(C(=O)O)n1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ NAPEPLD Q6IQ20 9/20 0.40
▸ EHMT2 Q96KQ7 3/20 0.38
▸ EHMT1 Q9H9B1 3/20 0.38
▸ PTPN11 Q06124 1/20 0.34
▸ GPR84 Q9NQS5 1/20 0.33
▸ PPARG P37231 1/20 0.33
▸ FLT3 P36888 1/20 0.32
▸ TYRO3 Q06418 1/20 0.32
▸ MERTK Q12866 1/20 0.32
▸ GAS6 Q14393 1/20 0.32
▸ HCAR2 Q8TDS4 1/20 0.32

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
SCHEMBL23304367 0.91 NAPEPLD (0.39) NAPEPLDEHMT2EHMT1
SCHEMBL23684701 0.87 NAPEPLD (0.36) NAPEPLDEHMT2EHMT1
SCHEMBL23304386 0.84 PIK3CA (0.40) NAPEPLDEHMT2EHMT1
SCHEMBL23304406 0.81 EHMT2 (0.36) NAPEPLDEHMT2EHMT1
SCHEMBL23329882 0.78 NAPEPLD (0.37) NAPEPLD
SCHEMBL23684473 0.76 EHMT2 (0.34) NAPEPLDEHMT2EHMT1
SCHEMBL25062941 0.76 NAPEPLD (0.39) NAPEPLD
SCHEMBL23304427 0.75 NAPEPLD (0.39) NAPEPLDEHMT2EHMT1
SCHEMBL17303810 0.73 HCRTR1 (0.37) EHMT2EHMT1
SCHEMBL25063004 0.73 NAPEPLD (0.40) NAPEPLDEHMT2EHMT1

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-2021086879-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2021-05-06 — — WO disclosed
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