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Sugi Predict / Compounds / SCHEMBL6854664

SCHEMBL6854664

SCHEMBL6854664

CC(C(=O)C1(N)C=CC(C(=O)O)C=C1)(c1cc(Cl)cc(Cl)c1)C(NC(N)=O)Oc1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CRHBP P24387 1/20 0.32
▸ CRHR2 Q13324 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
SCHEMBL12099897 0.80 ALDH1A1 (0.43) ALDH1A1MEN1KMT2ACRHBPCRHR2
SCHEMBL2583083 0.72 ALDH1A1 (0.37) ALDH1A1MEN1KMT2ACRHBPCRHR2
SCHEMBL2574153 0.72 KIF11 (0.36) ALDH1A1MEN1KMT2ACRHBPCRHR2
SCHEMBL5674972 0.70 PKM (0.31) —
SCHEMBL12468591 0.63 ALDH1A1 (0.43) ALDH1A1MEN1KMT2ACRHBPCRHR2
SCHEMBL11004596 0.54 PKM (0.41) ALDH1A1KMT2A
SCHEMBL8695089 0.53 ATM (0.45) ALDH1A1MEN1KMT2A
SCHEMBL9175649 0.52 MAPT (0.52) KMT2A
SCHEMBL27480198 0.51 KMT2A (0.50) ALDH1A1MEN1KMT2A
SCHEMBL3678377 0.51 MTNR1A (0.49) ALDH1A1MEN1KMT2A

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-6787566-B2 ADMINISTERING AN EFFECTIVE AMOUNT OF A COMPOUND SELECTED FROM ARYL(AND HETEROCYCLIC) UREIDO AND ARYL(HETEROCYCLIC) CARBOXAMIDO PHENOXYISOBUTYRIC ACIDS AS INHIBITOR OF GLYCATION AND ADVANCED GLYCATION ENDPRODUCTS (AGES) (PROTEIN-AGING) CITY OF HOPE 2004-09-07 — — US claimed