SCHEMBL28016544

SCHEMBL28016544

Cc1cc(C(=O)C=CN(C)C)ccc1OCc1c(C)cccc1Cc1ccc(C(=O)O)cc1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
LMNA P02545 1/20 0.41
MRGPRX4 Q96LA9 9/20 0.40
PPARA Q07869 1/20 0.37
GAA P10253 2/20 0.37
HTT P42858 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 1/20 0.37
RXRA P19793 1/20 0.36
RXRB P28702 1/20 0.36
RXRG P48443 1/20 0.36
NPC1 O15118 1/20 0.36
POLB P06746 1/20 0.36
HSP90AA1 P07900 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
RECQL P46063 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
SCHEMBL28819347 0.94 MAPT (0.40) MAPTLMNAMRGPRX4PPARAGAA
SCHEMBL28821202 0.86 MRGPRX4 (0.46) MRGPRX4RXRARXRBRXRG
SCHEMBL28024063 0.84 MRGPRX4 (0.43) MRGPRX4PPARAHPGDRXRARXRB
SCHEMBL28024050 0.84 MRGPRX4 (0.46) LMNAMRGPRX4PPARAALDH1A1RXRA
SCHEMBL28024548 0.84 MRGPRX4 (0.43) MRGPRX4RXRARXRBRXRG
SCHEMBL28016556 0.83 THRA (0.45) MRGPRX4
SCHEMBL28024078 0.81 MRGPRX4 (0.44) MRGPRX4RXRARXRBRXRG
SCHEMBL28024044 0.81 MRGPRX4 (0.41) MRGPRX4PPARARXRARXRBRXRG
SCHEMBL28024039 0.79 MRGPRX4 (0.42) MRGPRX4PPARARXRARXRBRXRG
SCHEMBL28102138 0.77 MRGPRX4 (0.42) MRGPRX4HTT

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
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
CN-104684908-A Tetrazolinone compounds and their use as pesticides SUMITOMO CHEMICAL CO 2015-06-03 CN disclosed