SCHEMBL3015467

SCHEMBL3015467

C=CCc1cc(OB(O)O)c(CC=C)c(CC=C)c1F

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.31
ALOX15 P16050 1/20 0.31
POLB P06746 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31

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
SCHEMBL3022769 0.81 PTGDR (0.35) CYP3A4ALOX15POLBGABRA1GABRB2
SCHEMBL3004710 0.76 CNR2 (0.33) CYP3A4ALOX15POLB
SCHEMBL3019941 0.76 MEN1 (0.34) POLBGABRA1GABRB2
SCHEMBL3017466 0.76 CNR2 (0.33) CYP3A4ALOX15POLB
SCHEMBL3019944 0.76 MEN1 (0.34) POLBGABRA1GABRB2
SCHEMBL2938726 0.76 PTGDR (0.34) POLBGABRA1GABRB2
SCHEMBL3008386 0.75 CNR2 (0.40) CYP3A4ALOX15POLBGABRA1GABRB2
SCHEMBL3015824 0.74 CNR2 (0.37) CYP3A4ALOX15GABRA1GABRB2
SCHEMBL3019558 0.73 MEN1 (0.34) POLBGABRA1GABRB2
SCHEMBL3019557 0.73 MEN1 (0.34) POLBGABRA1GABRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2226060-B1 CEMENT FOR DENTAL APPLICATIONS KURARAY NORITAKE DENTAL INC (JP) 2020-03-04 EP disclosed
US-8552088-B2 Cement for dental applications KURARAY NORITAKE DENTAL INC. (JP) 2013-10-08 US disclosed
US-20100267856-A1 CEMENT FOR DENTAL APPLICATIONS KURARAY MEDICAL INC. (JP) 2010-10-21 US disclosed
EP-2226060-A1 CEMENT FOR DENTAL APPLICATIONS Kuraray Medical Inc. (JP) 2010-09-08 EP disclosed
EP-0896043-B1 Adhesive TOKUYAMA CORP (JP) 2002-10-23 EP disclosed
US-6133338-A TYPIFIED BY 6-METHACRYLOYLOXYHEXYL 2-THIOURACIL-5-CARBOXYLATE, A RADICAL-POLYMERIZABLE MONOMER, AND A POLYMERIZATION INITIATOR; DENTAL ADHESIVE; GOOD ADHESIVENESS TO NOBLE METALS AND ALLOYS THEREOF TOKUYAMA CORPORATION (JP) 2000-10-17 US disclosed
EP-0896043-A1 Adhesive TOKUYAMA CORPORATION (JP) 1999-02-10 EP disclosed