SCHEMBL28630520

SCHEMBL28630520

CC[PH](O)(O)c1c[n+](C)nc2ccccc12

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ HPGD P15428 1/20 0.31

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
SCHEMBL22345375 0.67 ACP3 (0.47) —
SCHEMBL22345536 0.65 NR1I2 (0.37) KDM4EALDH1A1HPGD
SCHEMBL28634474 0.65 HDAC6 (0.46) —
Hydrochloric Acid SCHEMBL22345579 0.64 HDAC6 (0.45) —
SCHEMBL22345577 0.64 HDAC6 (0.33) KDM4EGAA
SCHEMBL22345540 0.64 — —
SCHEMBL28626091 0.64 KDM4E (0.33) KDM4EALDH1A1GAAHPGD
SCHEMBL22345526 0.63 NPY5R (0.43) KDM4EHPGD
SCHEMBL22345428 0.62 DDAH1 (0.30) —
SCHEMBL28641215 0.62 KDM4E (0.52) KDM4EALDH1A1GAAHPGD

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-113423694-A Cinnolinium compounds for use in a method for controlling unwanted plant growth 先正达农作物保护股份公司 2021-09-21 — — CN disclosed
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