SCHEMBL18794840

SCHEMBL18794840

NC(=O)COc1cc(Cl)cc(C(F)(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 2/20 0.46
KDM4E B2RXH2 1/20 0.43
SLC13A3 Q8WWT9 1/20 0.42
TACR1 P25103 4/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 1/20 0.41
FFAR4 Q5NUL3 1/20 0.40
MAOB P27338 1/20 0.40
AOC3 Q16853 1/20 0.40
TLR8 Q9NR97 1/20 0.39
RHOC P08134 1/20 0.39
RHOA P61586 1/20 0.39
GRM4 Q14833 1/20 0.38
SCN9A Q15858 1/20 0.38

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
SCHEMBL10931313 0.89 KDM4E (0.49) PDK2KDM4ETACR1ALDH1A1MAOB
SCHEMBL18794845 0.86 PTGDR2 (0.50) SLC13A3TACR1TDP1L3MBTL1FFAR4
SCHEMBL1815388 0.83 ALDH1A1 (0.45) PDK2KDM4EL3MBTL1ALDH1A1SCN9A
SCHEMBL18794874 0.82 PDK2 (0.48) PDK2KDM4ESLC13A3TACR1ALDH1A1
SCHEMBL18794839 0.80 PSEN1 (0.53) PDK2KDM4ESLC13A3TACR1TDP1
SCHEMBL18794849 0.76 SLC13A3 (0.40) SLC13A3TDP1L3MBTL1FFAR4TLR8
SCHEMBL10932863 0.76 KDM4E (0.71) PDK2KDM4EALDH1A1MAOBAOC3
SCHEMBL6507086 0.75 ALDH1A1 (0.68) PDK2TDP1ALDH1A1MAOBAOC3
SCHEMBL2113930 0.73 PPARD (0.52) KDM4E
SCHEMBL22289602 0.73 TACR1 (0.53) TACR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200181067-A1 FLUORINATED AMIDE DERIVATIVES AND THEIR USES AS THERAPEUTIC AGENTS TRILLIUM THERAPEUTICS INC. (CA) 2020-06-11 US disclosed
US-20200181067-A1 FLUORINATED AMIDE DERIVATIVES AND THEIR USES AS THERAPEUTIC AGENTS TRILLIUM THERAPEUTICS INC. (CA) 2020-06-11 US disclosed
US-10604476-B2 Fluorinated amide derivatives and their uses as therapeutic agents TRILLIUM THERAPEUTICS INC. (CA) 2020-03-31 US disclosed
US-20180334425-A1 FLUORINATED AMIDE DERIVATIVES AND THEIR USES AS THERAPEUTIC AGENTS TRILLIUM THERAPEUTICS INC. (CA) 2018-11-22 US disclosed
EP-3368509-A1 FLUORINATED AMIDE DERIVATIVES AND THEIR USES AS THERAPEUTIC AGENTS Trillium Therapeutics Inc. (CA) 2018-09-05 EP disclosed
WO-2017070795-A1 FLUORINATED AMIDE DERIVATIVES AND THEIR USES AS THERAPEUTIC AGENTS TRILLIUM THERAPEUTICS INC. (CA) 2017-05-04 WO disclosed
WO-2017070795-A1 FLUORINATED AMIDE DERIVATIVES AND THEIR USES AS THERAPEUTIC AGENTS TRILLIUM THERAPEUTICS INC. (CA) 2017-05-04 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180334425-A1 FLUORINATED AMIDE DERIVATIVES AND THEIR USES AS THERAPEUTIC AGENTS GRIN2A, ACHE, BDNF PDK2 1936/4885KDM4E 3359/4885SLC13A3 1803/4885
US-10604476-B2 Fluorinated amide derivatives and their uses as therapeutic agents GRIN2A, ACHE, BDNF PDK2 1936/4885KDM4E 3359/4885SLC13A3 1803/4885
US-20200181067-A1 FLUORINATED AMIDE DERIVATIVES AND THEIR USES AS THERAPEUTIC AGENTS GRIN2A, ACHE, BDNF PDK2 1936/4885KDM4E 3359/4885SLC13A3 1803/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.