SCHEMBL1623922

SCHEMBL1623922

CC(=CC(Cl)C(=O)O)C(=O)O.[MgH2]

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
LMNA P02545 1/20 0.36
PTGS1 P23219 1/20 0.32
AKR1C3 P42330 1/20 0.32
APEX1 P27695 2/20 0.31
THRB P10828 1/20 0.30
RECQL P46063 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
SCHEMBL1623712 0.95 ALDH1A1 (0.39) ALDH1A1LMNAPTGS1AKR1C3APEX1
SCHEMBL1623911 0.95 ALDH1A1 (0.39) ALDH1A1LMNAPTGS1AKR1C3APEX1
SCHEMBL11328575 0.75
SCHEMBL9168851 0.74
SCHEMBL1673409 0.74
SCHEMBL1623308 0.73 ALDH1A1 (0.32) ALDH1A1PTGS1AKR1C3APEX1
SCHEMBL153600 0.73 TP53 (0.33) ALDH1A1PTGS1AKR1C3APEX1
SCHEMBL8726421 0.73 PTGS1 (0.37) ALDH1A1PTGS1AKR1C3APEX1
SCHEMBL8726425 0.73 PTGS1 (0.37) ALDH1A1PTGS1AKR1C3APEX1
SCHEMBL4343590 0.72 TP53 (0.36) ALDH1A1LMNAPTGS1AKR1C3APEX1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7928175-B2 Antifouling paint composition MITSUBISHI RAYON CO., LTD. (JP) 2011-04-19 US disclosed
US-20060258772-A1 Antifouling paint composition MITSUBISHI RAYON CO. LTD. (JP) 2006-11-16 US disclosed