SCHEMBL9835594

SCHEMBL9835594

CCOc1cc(F)ccc1N(F)C(=O)Cl

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 7/20 0.41
MRGPRX1 Q96LB2 5/20 0.41
FFAR4 Q5NUL3 1/20 0.40
KCNQ3 O43525 1/20 0.38
KCNQ2 O43526 1/20 0.38
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
GLA P06280 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TSPO P30536 1/20 0.37

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
SCHEMBL11287767 0.76 MRGPRX1 (0.49) MRGPRX1FFAR4KCNQ3KCNQ2GLA
SCHEMBL9837234 0.75 RORC (0.40) KCNQ3KCNQ2MEN1MAPTKMT2A
SCHEMBL30628273 0.71 CYP3A4 (0.61) MRGPRX1FFAR4MAPTKMT2AL3MBTL1
SCHEMBL4271221 0.71 CYP3A4 (0.61) MRGPRX1FFAR4MAPTKMT2AL3MBTL1
SCHEMBL31078354 0.71 TSHR (0.56) MRGPRX1MEN1KMT2AGLAL3MBTL1
SCHEMBL3165420 0.71 CYP3A4 (0.61) MRGPRX1MAPTL3MBTL1TSPO
SCHEMBL1188345 0.71 TSHR (0.56) MRGPRX1MEN1KMT2AGLAL3MBTL1
SCHEMBL15048810 0.71 TSHR (0.51) MRGPRX1FFAR4MEN1KMT2AGLA
SCHEMBL30628345 0.71 CYP3A4 (0.61) MRGPRX1MAPTL3MBTL1TSPO
SCHEMBL2523519 0.70 L3MBTL1 (0.53) HRH4MRGPRX1MEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0241559-B1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-10-30 EP disclosed
US-4983751-A Chemical intermediates SAGAMI CHEMICAL RESEARCH CENTER (JP) 1991-01-08 US disclosed
US-4818272-A NONPHYTOTOXICITY FOR CROPS HELICAL STREAMS SAGAMI CHEMICAL RESEARCH CENTER (JP) 1989-04-04 US disclosed
EP-0241559-A1 OXAZOLIDINEDIONE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND HERBICIDES CONTAINING THE SAME SAGAMI CHEMICAL RESEARCH CENTER (JP) 1987-10-21 EP disclosed