SCHEMBL7055259

SCHEMBL7055259

C=C(CC(C)C)C(=O)OOC(=O)CC(C)=O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
TSHR P16473 1/20 0.36
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31
MMP9 P14780 1/20 0.31
MMP13 P45452 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
SCHEMBL623936 0.79 MGAM (0.43) ALDH1A1TDP1MGAMGAASI
SCHEMBL727178 0.77 ALDH1A1 (0.48) ALDH1A1TDP1MGAMGAASI
SCHEMBL6292365 0.76 MGAM (0.40) ALDH1A1MGAMGAASIMGAM2
SCHEMBL5495758 0.75 TSHR (0.40) ALDH1A1MGAMGAASIMGAM2
SCHEMBL5143369 0.75 MGAM (0.39) ALDH1A1MGAMGAASIMGAM2
SCHEMBL1783744 0.74 TSHR (0.40) ALDH1A1TDP1TSHRMMP1MMP2
SCHEMBL4887464 0.74 ALDH1A1 (0.44) ALDH1A1TDP1TSHRMMP1MMP2
SCHEMBL6292378 0.74 MGAM (0.38) ALDH1A1MGAMGAASIMGAM2
SCHEMBL609208 0.73 MGAM (0.67) ALDH1A1TDP1MGAMGAASI
SCHEMBL8960884 0.72 ALDH1A1 (0.44) ALDH1A1TDP1TSHRMMP1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1034229-B1 COATING COMPOSITIONS CONTAINING A HIGHLY FLUORINATED POLYMERIC ADDITIVE DU PONT (US) 2003-05-07 EP disclosed
EP-1034229-A1 COATING COMPOSITIONS CONTAINING A HIGHLY FLUORINATED POLYMERIC ADDITIVE E.I. DU PONT DE NEMOURS AND COMPANY (US) 2000-09-13 EP disclosed
US-5948851-A HYDROXY-CONTAINING ACRYLIC COPOLYMER, FLUORINATED ACRYLIC COPOLYMER, CROSSLINKING AGENT E. I. DU PONT DE NEMOURS AND COMPANY (US) 1999-09-07 US disclosed
WO-1999027025-A1 COATING COMPOSITIONS CONTAINING A HIGHLY FLUORINATED POLYMERIC ADDITIVE E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-06-03 WO disclosed