SCHEMBL29824281

SCHEMBL29824281

CC(C)CNC(=O)Nc1cc(F)c(F)c(F)c1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.62
▸ KDM4E B2RXH2 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ TAS1R3 Q7RTX0 1/20 0.42
▸ TAS1R1 Q7RTX1 1/20 0.42
▸ TAS1R2 Q8TE23 1/20 0.42
▸ KMT2A Q03164 3/20 0.40
▸ GAA P10253 1/20 0.40
▸ HSD17B10 Q99714 1/20 0.40
▸ NAMPT P43490 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ IDO1 P14902 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
SCHEMBL5243485 0.78 LMNA (0.64) LMNAALDH1A1MAPTHTTKMT2A
SCHEMBL31308946 0.77 LMNA (1.00) LMNAKDM4EALDH1A1MAPTHTT
SCHEMBL26623231 0.76 KDM4E (0.60) LMNAKDM4EALDH1A1MAPTGAA
SCHEMBL22450023 0.74 MAPT (0.56) LMNAKDM4EALDH1A1MAPTHTT
SCHEMBL10596294 0.74 LMNA (0.61) LMNAKDM4EALDH1A1MAPTHTT
SCHEMBL21503655 0.73 KMT2A (0.55) LMNAKDM4EALDH1A1MAPTHTT
SCHEMBL21782109 0.72 ESR1 (0.39) LMNAKDM4EALDH1A1MAPTHTT
SCHEMBL5243478 0.72 LMNA (1.00) LMNAALDH1A1HTTTAS1R3TAS1R1
SCHEMBL22535071 0.71 RAB9A (0.59) LMNAKMT2AMEN1
SCHEMBL27861126 0.71 RAB9A (0.60) LMNAALDH1A1MAPTKMT2ANAMPT

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-115087486-A Substituted bicyclic and tricyclic ureas and amides, analogs thereof, and methods of use thereof 爱彼特生物制药公司 2022-09-20 — — CN disclosed
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