SCHEMBL6037812

SCHEMBL6037812

C=CC(C(COC(=O)CC)c1ccccc1)P(=O)(O)Cc1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.34
LMNA P02545 2/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34
HTT P42858 1/20 0.34
LPAR1 Q92633 3/20 0.33
CYP2D6 P10635 1/20 0.33
PKM P14618 2/20 0.33
RECQL P46063 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ACP3 P15309 1/20 0.33
MAPT P10636 1/20 0.32
POLB P06746 1/20 0.32
BLM P54132 1/20 0.32
CHRM1 P11229 1/20 0.32
KLK7 P49862 2/20 0.32
PIN1 Q13526 1/20 0.32

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
SCHEMBL5051204 0.72 SLC6A2 (0.40) CYP2D6PIN1
SCHEMBL5057860 0.72 GRM8 (0.39) GAA
SCHEMBL5051257 0.71 SLC6A2 (0.40) LMNAKMT2ACYP2D6PIN1
SCHEMBL19275401 0.68 CA12 (0.50) LMNAKMT2ACYP2D6PKMSMN1; SMN2
SCHEMBL5054492 0.68 CETP (0.41) RAB9ALMNACYP2D6SMN1; SMN2
SCHEMBL12067390 0.67 CYP2C19 (0.41) KMT2ASMN1; SMN2
SCHEMBL5057886 0.66 ACP3 (0.39) KMT2AACP3
SCHEMBL24313823 0.66 CYP1A2 (0.50) LMNAKMT2ACYP2D6PKMSMN1; SMN2
SCHEMBL4352840 0.66 LMNA (0.52) RAB9ALMNAKMT2ACYP2D6PKM
SCHEMBL27686619 0.66 CYP1A2 (0.43) LMNAKMT2ACYP2D6PKMSMN1; 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 8 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
WO-2006093991-A1 COMPOUNDS WHICH BIND PSMA AND USES THEREOF THE CLEVELAND CLINIC FOUNDATION (US) 2006-09-08 WO disclosed
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
US-6025345-A NOVEL PHOSPHONATE DERIVATIVES, HYDROXYPHOSPHINYL DERIVATIVES, AND PHOSPHORAMIDATE DERIVATIVES THAT INHIBIT N-ACETYLATED .ALPHA.-LINKED ACIDIC DIPEPTIDASE (NAALADASE) ENZYME ACTIVITY, GUILFORD PHARMACEUTICALS INC. (US) 2000-02-15 US disclosed
WO-1998053812-A1 INHIBITORS OF NAALADASE ENZYME ACTIVITY GUILFORD PHARMACEUTICALS INC. (US) 1998-12-03 WO disclosed