SCHEMBL10432567

SCHEMBL10432567

CC(C)(C)C(=O)c1cccc(C(=O)CN)c1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 3/20 0.44
▸ ALOX5 P09917 1/20 0.40
▸ LOXL2 Q9Y4K0 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.37
▸ F2 P00734 1/20 0.36
▸ F10 P00742 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ HRH4 Q9H3N8 1/20 0.36
▸ HRH3 Q9Y5N1 1/20 0.36
▸ ATM Q13315 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ PARP1 P09874 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35

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
SCHEMBL10031819 0.84 ACHE (0.52) ACHEALOX5NPSR1ATMTDP1
SCHEMBL12518234 0.84 ACHE (0.45) ACHEALOX5NPSR1ATML3MBTL1
SCHEMBL10432594 0.81 NPC1 (0.39) LOXL2TDP1L3MBTL1KMT2AHSD17B10
SCHEMBL11988934 0.79 PARP1 (0.57) ACHEALOX5TDP1L3MBTL1PARP1
SCHEMBL27881331 0.79 ALDH1A1 (0.46) TDP1GAAKMT2A
SCHEMBL19340044 0.79 ACHE (0.41) ACHEALOX5NPSR1CYP2D6HRH4
SCHEMBL13028737 0.79 LOXL2 (0.60) ACHELOXL2F10
SCHEMBL5337977 0.78 SLC7A5 (0.55) ACHELOXL2F2CYP2D6TDP1
SCHEMBL6677622 0.77 CYP1A2 (0.53) ATMTDP1L3MBTL1HSD17B10
SCHEMBL13543258 0.77 ALDH1A1 (0.47) ACHEALOX5NPSR1TDP1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3789426-A1 POLYARYLETHER KETONE IMIDE SULFONE ADHESIVES The Boeing Company (US) 2021-03-10 — — EP disclosed
EP-0374789-A1 5- Aminoflavone derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 1990-06-27 — — EP disclosed
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