SCHEMBL6276544

SCHEMBL6276544

CCCCCCCCCCCCCCCC1(O)C=CC=CC1O

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
POLA1 P09884 2/20 0.47
DNTT P04053 1/20 0.39
POLB P06746 1/20 0.39
GAA P10253 4/20 0.33
GBA1 P04062 6/20 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
SCHEMBL10875328 1.00 POLA1 (0.47) POLA1DNTTPOLBGAAGBA1
SCHEMBL2975191 0.93 POLA1 (0.39) POLA1DNTTPOLB
SCHEMBL3007350 0.85 POLA1 (0.31) POLA1
SCHEMBL4146571 0.83 POLA1 (0.41) POLA1DNTTPOLBGAA
SCHEMBL27578070 0.80 POLA1 (0.38) POLA1DNTTPOLBGAAGBA1
SCHEMBL28256306 0.79 POLA1 (0.41) POLA1DNTTPOLB
SCHEMBL29192814 0.77 POLA1 (0.39) POLA1DNTTPOLB
SCHEMBL29210938 0.77 POLA1 (0.43) POLA1DNTTPOLB
SCHEMBL670329 0.76 POLA1 (0.35) POLA1GAA
SCHEMBL11324268 0.76 POLA1 (0.42) POLA1DNTTPOLB

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
WO-2005107788-A1 INHIBITION OF ALLERGIC CONTACT DERMATITIS BY N-L-ALPHA-ASPARTYL-L-PHENYLALANINE 1-METHYL ESTER OKLAHOMA MEDICAL RESEARCH FOUNDATION (US) 2005-11-17 WO disclosed
EP-0722463-B1 METHODS AND COMPOSITION FOR THE MODULATION OF HOST IMMUNE RESPONSE TO ALLERGENS ALLERGENE INC (US) 2003-03-19 EP disclosed
US-5512283-A VACCINATING WITH MONOCLONAL ANTIBODY ALLERGENE, INC. (US) 1996-04-30 US disclosed