SCHEMBL7873508

SCHEMBL7873508

CCCCCCCCCC(=O)OOC(C)(C)C1CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.55
DGKA P23743 1/20 0.41
EPHX2 P34913 4/20 0.40
EPHX1 P07099 8/20 0.39
LMNA P02545 2/20 0.39

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
SCHEMBL4608949 0.90 NAAA (0.50) NAAADGKAEPHX2LMNA
SCHEMBL28189672 0.88 NAAA (0.58) NAAADGKAEPHX2LMNA
SCHEMBL57356 0.87 NAAA (0.40) NAAAEPHX2EPHX1LMNA
SCHEMBL28216713 0.86 NAAA (0.55) NAAADGKAEPHX2LMNA
SCHEMBL38657216 0.85 NAAA (0.40) NAAAEPHX2
SCHEMBL2777469 0.80 SSTR4 (0.35) NAAAEPHX2EPHX1
SCHEMBL10649840 0.79 NAAA (0.45) NAAAEPHX2EPHX1LMNA
SCHEMBL94162 0.79 NAAA (0.38) NAAAEPHX2
SCHEMBL6661974 0.77 NAAA (0.33) NAAAEPHX2
SCHEMBL9566601 0.76 DGKA (0.53) DGKALMNA

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
US-6326454-B1 ANTISCALING AGENTS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-12-04 US disclosed
US-6121390-A ANTISCALING AGENT FOR APPARATUS USED FOR THE POLYMERIZATION OF VINYL CHLORIDE BY USING A DIMER, 2,2'3,3'-TETRAHYDROXY-1.1'BINAPHTHYL AND FORMALDEHYDE TO COAT THE VESSEL AND AGITATOR; DISCOLORATION INHIBITION; QUALITY SHIN-ETSU CHEMICAL CO., LTD. (JP) 2000-09-19 US disclosed
EP-0857739-A1 Polymer scale deposition preventive agent SHIN-ETSU CHEMICAL CO., LTD. (JP) 1998-08-12 EP disclosed