SCHEMBL8664138

SCHEMBL8664138

[Na].[Na].c1ccc(-c2cn[nH]n2)cc1.c1ccc(-c2cn[nH]n2)cc1

nearest known ligand 0.95

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 15/20 0.95
IDO1 P14902 7/20 0.95
KEAP1 Q14145 1/20 0.95
SIRT3 Q9NTG7 1/20 0.62
METAP1 P53582 1/20 0.61
NOTUM Q6P988 1/20 0.61

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
SCHEMBL8221447 0.98 METAP2 (1.00) METAP2IDO1KEAP1SIRT3METAP1
SCHEMBL5025520 0.77 IDO1 (1.00) METAP2IDO1KEAP1SIRT3METAP1
SCHEMBL29539786 0.77 METAP2 (1.00) METAP2IDO1KEAP1SIRT3METAP1
SCHEMBL28058540 0.77 METAP2 (1.00) METAP2IDO1KEAP1SIRT3METAP1
SCHEMBL28033548 0.76 METAP2 (0.64) METAP2IDO1KEAP1SIRT3METAP1
SCHEMBL104083 0.76 METAP2 (0.64) METAP2IDO1KEAP1SIRT3METAP1
SCHEMBL1030506 0.76 METAP2 (0.63) METAP2IDO1KEAP1SIRT3METAP1
SCHEMBL29626826 0.76 METAP2 (1.00) METAP2IDO1KEAP1SIRT3METAP1
SCHEMBL28070596 0.76 METAP2 (1.00) METAP2IDO1KEAP1SIRT3METAP1
SCHEMBL28434910 0.75 METAP2 (0.61) METAP2IDO1KEAP1SIRT3METAP1

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
US-5776878-A CONTAINING ANTISOILANT THE PROCTER & GAMBLE COMPANY (US) 1998-07-07 US disclosed