SCHEMBL7928411

SCHEMBL7928411

CC(C(C)(C(=O)O)C1CCCCC1)P(=O)(O)Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 9/20 0.40
MMP13 P45452 4/20 0.40
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38
ANPEP P15144 2/20 0.37
ERAP2 Q6P179 2/20 0.37
EPHX2 P34913 3/20 0.36
CHRM3 P20309 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KLK7 P49862 1/20 0.36

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
SCHEMBL7605953 0.75 MMP1 (0.44) MMP1MMP13KEAP1NFE2L2EPHX2
SCHEMBL7604579 0.74 MMP1 (0.41) MMP1MMP13KEAP1NFE2L2EPHX2
SCHEMBL7610962 0.73 MMP1 (0.41) MMP1MMP13KEAP1NFE2L2ANPEP
SCHEMBL5059759 0.72 MMP1 (0.45) MMP1MMP13ANPEPERAP2
SCHEMBL7931904 0.68 ALDH1A1 (0.38) MMP1ANPEPERAP2SMN1; SMN2
SCHEMBL8457577 0.68 CYP19A1 (0.44) CHRM3
SCHEMBL27796188 0.68 CTSS (0.35) KEAP1NFE2L2
SCHEMBL5060074 0.66 MMP1 (0.45) MMP1MMP13ANPEPERAP2EPHX2
SCHEMBL5051256 0.66 HPGD (0.49) SMN1; SMN2
SCHEMBL7605214 0.66 KDM4E (0.38) EPHX2SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0994707-A4 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARM INC (US) 2001-11-14 EP claimed
EP-0994707-A1 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARMACEUTICALS INC. (US) 2000-04-26 EP claimed
WO-1998053812-A1 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARMACEUTICALS INC. (US) 1998-12-03 WO claimed
EP-0994707-A4 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARM INC (US) 2001-11-14 EP disclosed
EP-0994707-A1 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARMACEUTICALS INC. (US) 2000-04-26 EP disclosed
WO-1998053812-A1 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARMACEUTICALS INC. (US) 1998-12-03 WO disclosed