SCHEMBL28102138

SCHEMBL28102138

Cc1cc(-n2nc(C)c(C)c2C)ccc1OCc1c(C)cccc1Cc1ccc(C(=O)O)cc1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 9/20 0.42
SLC22A12 Q96S37 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
AR P10275 1/20 0.35
P2RX7 Q99572 1/20 0.35
HTT P42858 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PTGER1 P34995 1/20 0.35

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
SCHEMBL28102154 0.94 MRGPRX4 (0.42) MRGPRX4L3MBTL1ARHTTMEN1
SCHEMBL28102044 0.93 MRGPRX4 (0.41) MRGPRX4SLC22A12ARP2RX7MEN1
SCHEMBL28102025 0.93 MRGPRX4 (0.45) MRGPRX4P2RX7PTGER1
SCHEMBL28102139 0.93 MRGPRX4 (0.41) MRGPRX4L3MBTL1ARP2RX7PTGER1
SCHEMBL28102108 0.86 MRGPRX4 (0.42) MRGPRX4ARHTTMEN1KMT2A
SCHEMBL28821202 0.83 MRGPRX4 (0.46) MRGPRX4
SCHEMBL28020702 0.82 MRGPRX4 (0.39) MRGPRX4L3MBTL1ARP2RX7
SCHEMBL28024548 0.81 MRGPRX4 (0.43) MRGPRX4
SCHEMBL28024063 0.81 MRGPRX4 (0.43) MRGPRX4
SCHEMBL28024050 0.81 MRGPRX4 (0.46) MRGPRX4

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
CN-104684908-B Terazololine-one compound and the purposes as insecticide thereof 住友化学株式会社 2016-09-28 CN disclosed