SCHEMBL28101410

SCHEMBL28101410

C1=Cc2cc3ccc(cc4nc(cc5ccc(cc1n2)[nH]5)C=C4)[nH]3.Oc1ccc([Co])cc1O

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.31
▸ STAT1 P42224 1/20 0.31
▸ GUSB P08236 2/20 0.31
▸ MGAM O43451 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ SI P14410 1/20 0.31
▸ MGAM2 Q2M2H8 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
SCHEMBL29145240 0.83 STAT3 (0.33) STAT3STAT1GAA
Catechol SCHEMBL28853360 0.80 STAT3 (0.41) STAT3STAT1GUSBMGAMGAA
SCHEMBL28088104 0.80 STAT3 (0.31) STAT3STAT1GUSBMGAMGAA
SCHEMBL1602488 0.80 STAT3 (0.41) STAT3STAT1
SCHEMBL11341946 0.78 STAT3 (0.40) STAT3STAT1
Iodide SCHEMBL11341933 0.78 STAT3 (0.40) STAT3STAT1
Hydrogen Peroxide SCHEMBL28310892 0.78 STAT3 (0.43) STAT3STAT1
SCHEMBL29430977 0.78 STAT3 (0.42) STAT3STAT1
SCHEMBL30821407 0.78 STAT3 (0.42) STAT3STAT1
SCHEMBL15809 0.78 STAT3 (0.42) STAT3STAT1

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-105906637-A Preparation method of Meso-tetra(3,4-dimethoxy phenyl) porphyrin cobalt 广东工业大学 2016-08-31 — — CN disclosed
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