SCHEMBL27637120

SCHEMBL27637120

O=C(O)CC1=Cc2cc3ccc(cc4nc(cc5[nH]c(c(CC(=O)O)c1n2)c(CC(=O)O)c5CC(=O)O)C=C4)[nH]3

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ CYP2C19 P33261 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
SCHEMBL15162400 0.73 — —
SCHEMBL11657135 0.73 — —
SCHEMBL11651487 0.72 — —
SCHEMBL9450931 0.72 STAT3 (0.46) CYP1A2CYP3A4CYP2C19
SCHEMBL7256935 0.71 — —
SCHEMBL9437991 0.70 — —
SCHEMBL9450936 0.70 STAT3 (0.37) CYP1A2
SCHEMBL18229760 0.70 STAT3 (0.36) —
Malonic Acid SCHEMBL27560828 0.70 STAT3 (0.36) —
Malonic Acid SCHEMBL5133240 0.70 STAT3 (0.36) —

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-1726502-A On-line verification of an authentication mark applied to products or product packaging SUN CHEMICAL BV (NL) 2006-01-25 — — CN disclosed
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