SCHEMBL7604654

SCHEMBL7604654

CCC(C(=O)O)c1cccnc1NP(=O)(O)Cc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.37
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
FDPS P14324 4/20 0.36
LMNA P02545 3/20 0.35
KDM4E B2RXH2 3/20 0.35
MAPT P10636 3/20 0.35
GLA P06280 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GAA P10253 1/20 0.34
ALDH1A1 P00352 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
DHODH Q02127 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
POLB P06746 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
P4HTM Q9NXG6 1/20 0.33

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
SCHEMBL7610263 0.91 HTT (0.36) HTTKMT2AMEN1FDPSLMNA
SCHEMBL7609432 0.86 FDPS (0.40) HTTKMT2AMEN1FDPSLMNA
SCHEMBL7614101 0.77 L3MBTL1 (0.41) KMT2ALMNAGAAALDH1A1SMN1; SMN2
SCHEMBL7606135 0.75 ANPEP (0.35) KDM4EALDH1A1SMN1; SMN2L3MBTL1POLB
SCHEMBL7607672 0.72 LMNA (0.36) HTTKMT2AFDPSLMNAKDM4E
SCHEMBL6178335 0.70 P2RX7 (0.42) LMNAALDH1A1SMN1; SMN2
SCHEMBL7610494 0.69 GAA (0.38) HTTKMT2AMEN1FDPSLMNA
SCHEMBL7609447 0.69 ACP3 (0.36) HTTKMT2AMEN1LMNAKDM4E
SCHEMBL7604500 0.68 ALOX5 (0.39) KMT2AMEN1KDM4EMAPTGAA
SCHEMBL7606743 0.68 L3MBTL1 (0.40) KMT2AL3MBTL1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002515040-A 2002-05-21 JP claimed
EP-0954295-A1 METHODS OF CANCER TREATMENT USING NAALADASE INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 1999-11-10 EP claimed
WO-1997048409-A1 METHODS OF CANCER TREATMENT USING NAALADASE INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 1997-12-24 WO claimed
US-6046180-A NAALADase inhibitors GUILFORD PHARMACEUTICALS INC. (US) 2000-04-04 US disclosed
EP-0954295-A1 METHODS OF CANCER TREATMENT USING NAALADASE INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 1999-11-10 EP disclosed
EP-0936914-A4 1999-08-25 EP disclosed
EP-0936914-A1 HYDROXY-PHOSPHINYL DERIVATIVES USEFUL AS NAALADASE INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 1999-08-25 EP disclosed
WO-1997048400-A1 HYDROXY-PHOSPHINYL DERIVATIVES USEFUL AS NAALADASE INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 1997-12-24 WO disclosed
WO-1997048409-A1 METHODS OF CANCER TREATMENT USING NAALADASE INHIBITORS GUILFORD PHARMACEUTICALS INC. (US) 1997-12-24 WO disclosed