SCHEMBL11554378

SCHEMBL11554378

Cc1nc(=O)n(C)c(=O)n1C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.36
KDM4C Q9H3R0 3/20 0.36
NPC1 O15118 3/20 0.36
ABL1 P00519 3/20 0.36
POLB P06746 3/20 0.36
MAPT P10636 3/20 0.36
RAB9A P51151 3/20 0.36
GALK1 P51570 3/20 0.36
BLM P54132 3/20 0.36
RIN1 Q13671 3/20 0.36
NPSR1 Q6W5P4 3/20 0.36
TDP2 O95551 3/20 0.36
KDM4A O75164 2/20 0.36
TP53 P04637 2/20 0.36
MPI P34949 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ATG4B Q9Y4P1 2/20 0.36
APAF1 O14727 1/20 0.36
S1PR2 O95136 1/20 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
SCHEMBL12149795 0.74 KDM4C (0.41) LMNAKDM4CNPC1ABL1POLB
SCHEMBL13760637 0.69 TNF (0.32)
SCHEMBL3540959 0.69 ADORA2B (0.36) MAPTKMT2ARECQLTSHRADORA2A
SCHEMBL12149800 0.69 KDM4E (0.32) LMNAKDM4CNPC1ABL1POLB
SCHEMBL12561756 0.67
SCHEMBL20803476 0.67
SCHEMBL2704481 0.66 KMT2A (0.59) MAPTL3MBTL1KMT2ARXFP1ALDH1A1
SCHEMBL141994 0.65 GSK3A (0.44) POLBHTTPIK3CDPIK3CAPIK3CB
SCHEMBL13024710 0.64 ATAD2 (0.39) LMNAPOLBKDM4EHTTALDH1A1
SCHEMBL13470502 0.62 CA12 (0.31) CA12CA1CA2CA3CA4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4174445-A INSECTICIDES BAYER AKTIENGESELLSCHAFT (DE) 1979-11-13 US disclosed
US-4048315-A NEMATOCIDES BAYER AKTIENGESELLSCHAFT (DT) 1977-09-13 US disclosed