SCHEMBL28393294

SCHEMBL28393294

CCc1cccc2c1NC(=O)CC(=O)N2c1ccc(OC(N)=O)c(C(C)(C)C)c1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.42
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
LMNA P02545 1/20 0.42
HSD17B10 Q99714 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
P2RX4 Q99571 12/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
POLB P06746 1/20 0.33

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
SCHEMBL16239039 0.75 MAPT (0.56) MAPTMEN1KMT2ALMNAHSD17B10
SCHEMBL16239668 0.73 P2RX4 (0.48) MAPTMEN1KMT2ALMNAP2RX4
SCHEMBL16239116 0.72 P2RX4 (0.56) MAPTMEN1KMT2ALMNAHSD17B10
SCHEMBL16238983 0.66 P2RX4 (0.57) MAPTMEN1KMT2ALMNAP2RX4
SCHEMBL30094417 0.66 P2RX4 (0.57) MAPTMEN1KMT2ALMNAP2RX4
SCHEMBL28425415 0.64 MAPT (0.44) MAPTMEN1KMT2ALMNAHSD17B10
SCHEMBL8956337 0.63 ALDH1A1 (0.48) MEN1KMT2ALMNAHSD17B10SMN1; SMN2
SCHEMBL11035766 0.61 MAPT (1.00) MAPTMEN1KMT2ALMNAHSD17B10
SCHEMBL16239054 0.61 MAPT (0.52) MAPTMEN1KMT2ALMNAHSD17B10
SCHEMBL26933630 0.61 P2RX4 (0.53) MAPTMEN1KMT2ALMNAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108863959-B P2X4 receptor antagonists 日本化学药品株式会社 2021-11-30 CN disclosed
CN-111333588-A P2X4 receptor antagonists 日本化学药品株式会社 2020-06-26 CN disclosed
CN-104066724-B P2X4 receptor antagonists 日本化学药品株式会社 2020-04-17 CN disclosed