SCHEMBL5841271

SCHEMBL5841271

C=C(C)CONC(Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.49
SLC7A5 Q01650 1/20 0.46
NAALAD2 Q9Y3Q0 1/20 0.46
MME P08473 6/20 0.45
ACE P12821 6/20 0.45
CPA1 P15085 1/20 0.45
ACE2 Q9BYF1 1/20 0.45
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
ESR1 P03372 2/20 0.41
ESR2 Q92731 2/20 0.41

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
SCHEMBL5842234 0.89 FPR2 (0.47) SLC7A5NAALAD2MMEACECPA1
SCHEMBL9577258 0.88 ACE (0.43) FOLH1SLC7A5ACECA1ESR1
SCHEMBL11035786 0.84 ITGB3 (0.43) MMEACECPA1ACE2KMT2A
SCHEMBL475962 0.82 FOLH1 (0.54) FOLH1SLC7A5NAALAD2MMEACE
SCHEMBL475961 0.82 FOLH1 (0.54) FOLH1SLC7A5NAALAD2MMEACE
SCHEMBL33332 0.81 FOLH1 (0.49) FOLH1SLC7A5NAALAD2MMEACE
SCHEMBL33331 0.81 FOLH1 (0.49) FOLH1SLC7A5NAALAD2MMEACE
SCHEMBL27775469 0.80 FOLH1 (0.48) FOLH1SLC7A5NAALAD2MMEACE
SCHEMBL27775468 0.80 FOLH1 (0.48) FOLH1SLC7A5NAALAD2MMEACE
SCHEMBL476061 0.79 FOLH1 (0.56) FOLH1SLC7A5NAALAD2MMEACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7115674-B2 Dental self-curing resin cement compositions DENTKIST, INC. (KR) 2006-10-03 US claimed
US-20050049326-A1 Dental self-curing resin cement compositions DENTKIST, INC. (KR) 2005-03-03 US claimed
US-7115674-B2 Dental self-curing resin cement compositions DENTKIST, INC. (KR) 2006-10-03 US disclosed
US-20050049326-A1 Dental self-curing resin cement compositions DENTKIST, INC. (KR) 2005-03-03 US disclosed
US-5264513-A Dental adhesive KABUSHIKI KAISHA SHOFU (JP) 1993-11-23 US disclosed