SCHEMBL20116582

SCHEMBL20116582

CON(C)C(=O)c1ccc(C)nc1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MLYCD O95822 1/20 0.38
TRPM8 Q7Z2W7 2/20 0.38
PIK3CA P42336 4/20 0.36
MTOR P42345 4/20 0.36
CLK1 P49759 1/20 0.35
DYRK1A Q13627 1/20 0.35
DYRK1B Q9Y463 1/20 0.35
RAB9A P51151 2/20 0.33
NPC1 O15118 1/20 0.33
CASP3 P42574 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
ICAM1 P05362 1/20 0.33
SELE P16581 1/20 0.33
GPR119 Q8TDV5 2/20 0.32
KDM4E B2RXH2 1/20 0.32
NNMT P40261 1/20 0.32
SORT1 Q99523 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
SCHEMBL30506324 0.85 TRPM8 (0.41) MLYCDTRPM8PIK3CAMTORCLK1
SCHEMBL4096529 0.85 TRPM8 (0.41) MLYCDTRPM8PIK3CAMTORCLK1
SCHEMBL16460198 0.83 NNMT (0.40) MLYCDTRPM8PIK3CAMTORCLK1
SCHEMBL30851652 0.81 PIK3CA (0.37) MLYCDTRPM8PIK3CAMTORCLK1
SCHEMBL847606 0.81 EGFR (0.43) MLYCDTRPM8PIK3CAMTORCLK1
SCHEMBL781008 0.75 NAPRT (0.56) MLYCDTRPM8RAB9ANPC1SMN1; SMN2
SCHEMBL13265171 0.73 MLYCD (0.40) MLYCDTRPM8PIK3CAMTORCLK1
SCHEMBL21679329 0.73 MLYCD (0.43) MLYCDTRPM8PIK3CAMTORCLK1
SCHEMBL13265167 0.73 MLYCD (0.40) MLYCDTRPM8PIK3CAMTORCLK1
SCHEMBL27782317 0.73 NAPRT (0.47) SMN1; SMN2SORT1GABRA1MEN1KMT2A

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-2018081167-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2018-05-03 WO disclosed