SCHEMBL9136909

SCHEMBL9136909

CN1C(=CC=C2C(=O)C(=O)CC(=O)C2=O)N(C)c2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CES1 P23141 2/20 0.38
▸ TTR P02766 1/20 0.38
▸ EPHX2 P34913 2/20 0.36
▸ MEN1 O00255 5/20 0.35
▸ MAPT P10636 5/20 0.35
▸ KMT2A Q03164 5/20 0.35
▸ USP2 O75604 3/20 0.35
▸ NPC1 O15118 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ BRPF1 P55201 1/20 0.34
▸ TRPA1 O75762 1/20 0.34
▸ MTOR P42345 1/20 0.34
▸ POLB P06746 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ HTT P42858 2/20 0.34
▸ OPRL1 P41146 1/20 0.34
▸ MAPK1 P28482 1/20 0.33
▸ GABRA1 P14867 1/20 0.33
▸ GABRG2 P18507 1/20 0.33

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
SCHEMBL9355391 0.74 KMT2A (0.38) CES1TTREPHX2MEN1MAPT
SCHEMBL9135452 0.71 CES1 (0.40) CES1TTRMEN1MAPTKMT2A
SCHEMBL10623284 0.71 LMNA (0.50) CES1TTREPHX2MEN1MAPT
SCHEMBL13683810 0.71 KMT2A (0.45) CES1TTREPHX2MEN1MAPT
SCHEMBL23337592 0.70 ILF3 (0.39) CES1TTREPHX2MEN1MAPT
SCHEMBL10036025 0.69 KMT2A (0.54) MEN1MAPTKMT2AUSP2RAB9A
SCHEMBL13683624 0.67 TRPA1 (0.40) CES1TTREPHX2MEN1MAPT
SCHEMBL13683627 0.67 EPHX2 (0.33) CES1TTREPHX2MEN1MAPT
SCHEMBL13683621 0.67 L3MBTL1 (0.50) CES1TTREPHX2MEN1MAPT
SCHEMBL6518017 0.66 BRPF1 (0.53) CES1TTRMEN1MAPTKMT2A

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
US-5405968-A Useful as drugs, for producing singlet oxygen, sensitizers in electrophotographic layers and for photopolymerizations and as laser light sensitive dyes in optical recording media BASF AKTIENGESELLSCHAFT (DE) 1995-04-11 — — US disclosed
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