SCHEMBL24653293

SCHEMBL24653293

C=C(N)c1ccc(C(C)(C)C)nc1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 2/20 0.34
CLK2 P49760 2/20 0.34
NNMT P40261 4/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.31
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
NFKB1 P19838 1/20 0.31
RAB9A P51151 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
MLYCD O95822 1/20 0.31
LGMN Q99538 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
SCHEMBL1473350 0.82 MAPT (0.35) CLK1CLK2SMN1; SMN2NPC1TP53
SCHEMBL12775299 0.81 NNMT (0.55) NNMTSMN1; SMN2
SCHEMBL12227502 0.81 UBE2T (0.45)
SCHEMBL24016755 0.81 NPC1 (0.34) CLK1CLK2SMN1; SMN2NPC1TP53
SCHEMBL14206340 0.81 TRPV4 (0.48) MLYCD
SCHEMBL1474288 0.78 CLK1 (0.33) CLK1CLK2SMN1; SMN2NPC1TP53
SCHEMBL20304778 0.75 POLB (0.47) CLK1CLK2NNMTSMN1; SMN2NPC1
SCHEMBL5366444 0.74 KCNJ1 (0.44) CLK1CLK2SMN1; SMN2NPC1TP53
SCHEMBL1070876 0.74 P4HA1 (0.55) SMN1; SMN2MAPT
SCHEMBL17033581 0.74 HDAC1 (0.50) NNMTSMN1; SMN2MAPT

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
US-20220308056-A1 BIOMARKER FOR ASSESSING THE RISK OF DEVELOPING ACUTE COVID-19 AND POST-ACUTE COVID-19 OMEROS CORPORATION 2022-09-29 US disclosed