SCHEMBL19389385

SCHEMBL19389385

Cc1c(CC(=O)NCCCCC(NC(=O)NC(CCC(=O)O)C(=O)O)C(=O)O)c(=O)oc2c(F)c(O)c(F)cc12

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CTDSP1 Q9GZU7 2/20 0.51
▸ DUSP3 P51452 1/20 0.47
▸ PTPN5 P54829 1/20 0.47
▸ PTPN11 Q06124 1/20 0.47
▸ KMT2A Q03164 3/20 0.45
▸ FOLH1 Q04609 12/20 0.44
▸ POLB P06746 1/20 0.44
▸ CASP6 P55212 1/20 0.44
▸ MEN1 O00255 1/20 0.42
▸ KLK7 P49862 1/20 0.42
▸ GFER P55789 1/20 0.41

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
SCHEMBL10026010 1.00 CTDSP1 (0.51) CTDSP1DUSP3PTPN5PTPN11KMT2A
SCHEMBL13177562 1.00 CTDSP1 (0.51) CTDSP1DUSP3PTPN5PTPN11KMT2A
SCHEMBL10026113 0.94 CTDSP1 (0.51) CTDSP1DUSP3PTPN5PTPN11KMT2A
SCHEMBL18807596 0.94 CTDSP1 (0.48) CTDSP1DUSP3PTPN5PTPN11KMT2A
SCHEMBL13554387 0.81 CTDSP1 (0.43) CTDSP1DUSP3PTPN5PTPN11KMT2A
SCHEMBL1985951 0.74 POLB (0.53) CTDSP1DUSP3PTPN5PTPN11KMT2A
SCHEMBL18041269 0.70 POLB (0.42) CTDSP1KMT2APOLBCASP6MEN1
SCHEMBL18882648 0.70 POLB (0.42) CTDSP1KMT2APOLBCASP6MEN1
SCHEMBL14365796 0.68 MAPT (0.53) —
SCHEMBL21344719 0.68 FOLH1 (0.72) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3222617-B1 PSMA-TARGETING COMPOUNDS AND USES THEREOF UNIV JOHNS HOPKINS (US) 2022-07-06 — — EP disclosed
EP-3222617-A1 PSMA-TARGETING COMPOUNDS AND USES THEREOF The Johns Hopkins University (US) 2017-09-27 — — EP disclosed
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