SCHEMBL6416654

SCHEMBL6416654

O=C(O)c1cccc[n+]1-c1ncncn1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 2/20 0.32
LMNA P02545 1/20 0.32
P4HTM Q9NXG6 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
KMO O15229 1/20 0.31
DAO P14920 1/20 0.30
TSHR P16473 1/20 0.30
ALDH1A1 P00352 1/20 0.30
ALOX15 P16050 1/20 0.30

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
SCHEMBL123490 0.74 ALDH1A1 (0.37) NAPRTP4HTMDAOTSHRALDH1A1
SCHEMBL8356749 0.66 NPSR1 (0.34) ALDH1A1
Biphenyl SCHEMBL28790863 0.66 KMO (0.44) NAPRTLMNAP4HTML3MBTL1KMO
SCHEMBL8029541 0.66 KDM5B (0.31) NAPRTLMNAP4HTML3MBTL1
SCHEMBL4339618 0.64 KMT2A (0.47) NAPRTP4HTMKMODAOTSHR
SCHEMBL9007173 0.64 HSP90AA1 (0.33)
SCHEMBL1489277 0.63 KDM4E (0.44) NAPRTLMNAL3MBTL1DAOTSHR
SCHEMBL13113036 0.63 HDAC8 (0.43) NAPRTDAOTSHRALDH1A1ALOX15
SCHEMBL366002 0.63
SCHEMBL28317487 0.62 HDAC8 (0.41) NAPRTLMNADAOTSHRALDH1A1

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
US-20050031884-A1 Latex products SUZUKI LATEX INDUSTRY CO., LTD. (JP) 2005-02-10 US claimed
US-20050031884-A1 Latex products SUZUKI LATEX INDUSTRY CO., LTD. (JP) 2005-02-10 US disclosed