SCHEMBL29992092

SCHEMBL29992092

CC(=O)c1ccccc1NC(=O)OC(C)(C)C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXFP1 Q9HBX9 1/20 0.59
▸ PDK1 Q15118 1/20 0.55
▸ PDK2 Q15119 1/20 0.55
▸ PDK3 Q15120 1/20 0.55
▸ PDK4 Q16654 1/20 0.55
▸ POLB P06746 2/20 0.50
▸ LMNA P02545 1/20 0.50
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ IDO1 P14902 1/20 0.46
▸ CNR2 P34972 1/20 0.46
▸ BRD9 Q9H8M2 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ METAP1 P53582 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ ELANE P08246 1/20 0.43

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
SCHEMBL15368377 1.00 RXFP1 (0.59) RXFP1PDK1PDK2PDK3PDK4
SCHEMBL13804211 0.87 MEN1 (0.50) RXFP1PDK1PDK2PDK3PDK4
SCHEMBL29702265 0.87 RXFP1 (0.55) RXFP1POLBLMNAMEN1KMT2A
SCHEMBL29663621 0.87 RXFP1 (0.55) RXFP1POLBLMNAMEN1KMT2A
SCHEMBL222446 0.87 RXFP1 (0.55) RXFP1POLBLMNAMEN1KMT2A
SCHEMBL29324602 0.86 RXFP1 (0.52) RXFP1PDK1PDK2PDK3PDK4
SCHEMBL2880191 0.86 LMNA (0.54) RXFP1POLBLMNAMEN1KMT2A
SCHEMBL1542029 0.85 RXFP1 (0.54) RXFP1PDK1PDK2PDK3PDK4
SCHEMBL7540602 0.85 KDM4E (0.55) RXFP1POLBLMNAMEN1KMT2A
SCHEMBL18400201 0.85 RXFP1 (0.54) RXFP1PDK1PDK2PDK3PDK4

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
CN-113214113-B Preparation method of aniline para-trifluoromethylated derivative 苏州大学 2022-10-14 — — CN claimed
EP-4605400-A1 NOVEL TRIHETEROCYCLIC COMPOUNDS Idience Co., Ltd. (KR) 2025-08-27 — — EP disclosed
WO-2024085661-A1 NOVEL TRIHETEROCYCLIC COMPOUNDS ILDONG PHARMACEUTICAL CO., LTD. (KR) 2024-04-25 — — WO disclosed
CN-113214113-B Preparation method of aniline para-trifluoromethylated derivative 苏州大学 2022-10-14 — — CN disclosed
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