SCHEMBL8437985

SCHEMBL8437985

CCN(CC)CC.CCN(CC)CC.CCN(CC)CC.[Cr]

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.36
▸ MGLL Q99685 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.33
▸ CYP2C9 P11712 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ THRB P10828 1/20 0.32
▸ APEX1 P27695 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ CACNA1B Q00975 1/20 0.32
▸ APBA1 Q02410 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ MCL1 Q07820 1/20 0.32
▸ HKDC1 Q2TB90 1/20 0.32

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
SCHEMBL124190 0.94 — —
SCHEMBL30 0.94 — —
SCHEMBL1736341 0.94 ALDH1A1 (0.40) ALDH1A1MGLLHRH3CYP2C9HPGD
Hydrochloric Acid SCHEMBL3521843 0.89 — —
Fluoride SCHEMBL22345959 0.89 ALDH1A1 (0.36) ALDH1A1MGLLHRH3CYP2C9HPGD
SCHEMBL2166180 0.89 ALDH1A1 (0.36) ALDH1A1MGLLHRH3CYP2C9HPGD
Fluoride SCHEMBL99441 0.89 — —
Water SCHEMBL20920097 0.89 ALDH1A1 (0.36) ALDH1A1MGLLHRH3CYP2C9HPGD
Fluoride SCHEMBL2116095 0.89 — —
SCHEMBL3288050 0.89 — —

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-5945167-A COMPRESSION MOLDING AND FIRING OF MIXED METAL AND CERAMIC POWDERS, THEN IMPREGNATION WITH METAL SALT SOLUTION CONTAINING CERAMIC GRAIN GROWTH ACCELERATOR AND MORE FIRING GIVES HARD, TOUGH CUTTING TOOLS HONDA GIKEN KOGYO KABUSHIKI KAISHA (JP) 1999-08-31 — — US disclosed
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