SCHEMBL6832896

SCHEMBL6832896

CCCCC(CC)COC(C)Cc1cc(-n2nc3ccc(Cl)cc3n2)c(O)c(C(C)(C)C)c1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL76645 0.90 ALDH1A1 (0.34) ALDH1A1MAPK1
SCHEMBL208254 0.84 MMP2 (0.33) ALDH1A1MAPK1
SCHEMBL19834895 0.84 ALDH1A1 (0.44) ALDH1A1MAPK1
SCHEMBL76644 0.83 ALDH1A1 (0.43) ALDH1A1MAPK1
SCHEMBL29496845 0.83 ALDH1A1 (0.43) ALDH1A1MAPK1
SCHEMBL31631277 0.83 ALDH1A1 (0.36) ALDH1A1MAPK1
SCHEMBL6832895 0.82 ALDH1A1 (0.34) ALDH1A1MAPK1
SCHEMBL768969 0.82 ALDH1A1 (0.37) ALDH1A1MAPK1
SCHEMBL20694831 0.82 ALDH1A1 (0.36) ALDH1A1MAPK1
SCHEMBL295015 0.81 CA2 (0.34) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1401940-A1 POLYACETAL MOLDED ARTICLES STABILIZED AGAINST DISCOLORATION Ciba SC Holding AG (CH) 2004-03-31 EP disclosed
US-6492440-B1 A REACTION PRODUCT OF A HALOTRIAZINES; A STABILIZER FOR POLYETHYLENE OR POLYPROPYLENE; HEAT, OXIDATION AND LIGHT RESISTANCE, DISCOLORATION INHIBITION CIBA SPECIALTY CHEMICALS CORPORATION 2002-12-10 US disclosed
WO-2002088240-A1 POLYACETAL MOLDED ARTICLES STABILIZED AGAINST DISCOLORATION CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2002-11-07 WO disclosed