SCHEMBL6037845

SCHEMBL6037845

O=C(O)CCCCC(CCCCCP(=O)(O)Cc1ccccc1)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.49
CPA3 P15088 1/20 0.47
MAPT P10636 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
FOLH1 Q04609 2/20 0.46
TSHR P16473 1/20 0.45

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
SCHEMBL6037833 1.00 NPSR1 (0.49) NPSR1CPA3MAPTRXFP1FOLH1
SCHEMBL7607301 0.95 CPA3 (0.47) NPSR1CPA3MAPTRXFP1FOLH1
SCHEMBL5053110 0.88 FOLH1 (0.53) FOLH1
SCHEMBL5059943 0.88 FOLH1 (0.53) FOLH1
SCHEMBL5054569 0.88 FOLH1 (0.53) FOLH1
SCHEMBL5053188 0.86 FOLH1 (0.54) FOLH1
SCHEMBL6037839 0.85 CPA3 (0.58) CPA3FOLH1
SCHEMBL7604478 0.83 FOLH1 (0.52) FOLH1
SCHEMBL6037767 0.83 FOLH1 (0.46) FOLH1
SCHEMBL5051342 0.82 FOLH1 (0.59) FOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006093991-A1 COMPOUNDS WHICH BIND PSMA AND USES THEREOF THE CLEVELAND CLINIC FOUNDATION (US) 2006-09-08 WO disclosed