SCHEMBL8318657

SCHEMBL8318657

COC(=O)Cn1c(=O)n(C)c(=O)n(-c2cc(Oc3c(F)cc(C(F)(F)F)cc3Cl)ccc2Br)c1=O

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.35
▸ MEN1 O00255 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ PLA2G7 Q13093 7/20 0.33
▸ PTGDR2 Q9Y5Y4 1/20 0.32
▸ NPBWR1 P48145 1/20 0.32
▸ MCHR1 Q99705 1/20 0.32
▸ HIF1A Q16665 1/20 0.31
▸ TLR8 Q9NR97 2/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ THRB P10828 1/20 0.30
▸ TLR7 Q9NYK1 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ P2RX3 P56373 1/20 0.30

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
SCHEMBL8318409 0.93 LMNA (0.36) LMNAMEN1CYP2C9CYP2C19KMT2A
SCHEMBL9015950 0.92 PTGDR2 (0.40) PLA2G7PTGDR2HIF1ASMN1; SMN2THRB
SCHEMBL8320812 0.87 MEN1 (0.38) LMNAMEN1CYP2C19KMT2APLA2G7
SCHEMBL8321468 0.83 MAPK1 (0.33) PLA2G7NPBWR1MCHR1TLR8THRB
SCHEMBL9015972 0.81 FFAR1 (0.32) PLA2G7NPBWR1MCHR1HIF1ATHRB
SCHEMBL8326574 0.80 GRIN1 (0.37) KMT2APLA2G7PTGDR2SMN1; SMN2ALDH1A1
SCHEMBL8321355 0.80 MEN1 (0.37) LMNAMEN1CYP2C19KMT2APLA2G7
SCHEMBL8319192 0.79 BCAT2 (0.36) PLA2G7NPBWR1MCHR1
SCHEMBL8322789 0.79 MEN1 (0.41) MEN1CYP2C19KMT2APLA2G7PTGDR2
SCHEMBL8317525 0.79 FFAR1 (0.43) LMNAMEN1KMT2AMAPTTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5883282-A UREA CHEMICAL INTERMEDIATES; RICE AMERICAN CYANAMID COMPANY (US) 1999-03-16 — — US disclosed
US-5763605-A 3-(3-aryloxyphenyl)-1-(substituted methyl)-S-triazine-2,4,6-oxo or thiotrione herbicidal agents AMERICAN CYANAMID COMPANY (US) 1998-06-09 — — US disclosed
US-5670641-A 3-(3-aryloxyphenyl)-1-(substituted methyl)-S-triazine-2,4,6-oxo or thiotrione herbicidal agents AMERICAN CYANAMID COMPANY (US) 1997-09-23 — — US disclosed
US-5654256-A PREEMERGENCE, POSTEMERGENCE HERBICIDES AMERICAN CYANAMID COMPANY (US) 1997-08-05 — — US disclosed
US-5604180-A RICE CROPS AMERICAN CYANAMID COMPANY 1997-02-18 — — US disclosed
US-5519133-A CYCLIZATION, ALKYLATION AMERICAN CYANAMID CO. (US) 1996-05-21 — — US disclosed
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