SCHEMBL6033322

SCHEMBL6033322

O=C(O)c1ccc2c(c1)nnn2CCCl

nearest known ligand 0.74

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HCAR3 P49019 19/20 0.74
HPGD P15428 1/20 0.54
HCAR2 Q8TDS4 1/20 0.54
NAMPT P43490 1/20 0.49

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
SCHEMBL6044508 0.85 HCAR3 (1.00) HCAR3HPGDHCAR2
SCHEMBL6044288 0.84 HCAR3 (0.78) HCAR3HPGDHCAR2
SCHEMBL6044071 0.83 HCAR3 (1.00) HCAR3HPGDHCAR2
SCHEMBL15555892 0.83 HCAR3 (0.76) HCAR3HPGDHCAR2NAMPT
SCHEMBL6044058 0.82 HCAR3 (1.00) HCAR3HPGDHCAR2
SCHEMBL21728478 0.82 HCAR3 (0.73) HCAR3HPGDHCAR2NAMPT
SCHEMBL4544128 0.82 HCAR3 (0.73) HCAR3HPGDHCAR2NAMPT
SCHEMBL6044486 0.82 HCAR3 (1.00) HCAR3HPGDHCAR2
SCHEMBL6044256 0.82 HCAR3 (1.00) HCAR3HPGDHCAR2
SCHEMBL6044222 0.82 HCAR3 (0.73) HCAR3HPGDHCAR2NAMPT

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-20060227458-A1 Corrosion inhibitors and methods for magnetic media and magnetic head read-write device PACE TECHNOLOGIES CORPORATION (US) 2006-10-12 US claimed