SCHEMBL29055133

SCHEMBL29055133

CCOC(=O)C1(C)CC(c2cc(-c3ncc([N+](=O)[O-])cc3Cl)c(F)cc2Cl)=NO1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.35
▸ GLA P06280 1/20 0.34
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ POLB P06746 2/20 0.33
▸ GUSB P08236 1/20 0.33
▸ RAB9A P51151 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ NPC1 O15118 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ SSTR5 P35346 1/20 0.31
▸ ITGB1 P05556 1/20 0.31
▸ ITGA4 P13612 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ MAPK1 P28482 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
SCHEMBL29055115 0.89 CA1 (0.35) CA1CA2MEN1KMT2ASSTR5
SCHEMBL29055114 0.89 CA1 (0.35) CA1CA2RAB9ANPC1SSTR5
SCHEMBL29055123 0.89 CA1 (0.35) MAPTCA1CA2POLBALDH1A1
SCHEMBL24485256 0.89 CA1 (0.35) CA1CA2SSTR5ITGB1ITGA4
SCHEMBL24485252 0.88 CA1 (0.36) CA1CA2KDM4EALDH1A1SSTR5
SCHEMBL29712912 0.88 CA1 (0.36) CA1CA2KDM4EALDH1A1SSTR5
SCHEMBL24485261 0.87 SSTR5 (0.34) CA1CA2ALDH1A1SSTR5ITGB1
SCHEMBL29712903 0.87 SSTR5 (0.34) CA1CA2ALDH1A1SSTR5ITGB1
SCHEMBL29055132 0.87 CA1 (0.36) CA1CA2ALDH1A1MEN1KMT2A
SCHEMBL24485253 0.86 CA2 (0.33) CA1CA2SSTR5ITGB1ITGA4

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-116568673-A Herbicidal compounds 先正达农作物保护股份公司 2023-08-08 — — CN disclosed
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