SCHEMBL7607381

SCHEMBL7607381

CC(OP(=O)(O)Cc1ccccc1)(C(=O)O)c1ccccn1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
CETP P11597 6/20 0.38
BLM P54132 1/20 0.38
CYP2D6 P10635 1/20 0.38
POLB P06746 1/20 0.38
CHRM2 P08172 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35

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
SCHEMBL7605134 0.81 RAB9A (0.39) SMN1; SMN2HTTCETPPOLB
SCHEMBL7605187 0.78 FDPS (0.45) LMNAHTT
SCHEMBL7607667 0.76 LMNA (0.40) SMN1; SMN2LMNAHTTCETPBLM
SCHEMBL8059131 0.75 SMN1; SMN2 (0.41) SMN1; SMN2LMNAHTTCETPBLM
SCHEMBL7605890 0.74 HDAC1 (0.38) SMN1; SMN2CETPCHRM2
SCHEMBL7772647 0.74 HPGD (0.46) CETP
SCHEMBL7605208 0.73 ALDH1A1 (0.34) SMN1; SMN2LMNACETPPOLB
SCHEMBL7604569 0.73 PTPN1 (0.47) SMN1; SMN2LMNAHTTCETPCYP2D6
SCHEMBL7613491 0.73 ACP3 (0.44)
SCHEMBL7926683 0.72 CETP (0.37) SMN1; SMN2LMNAHTTCETPBLM

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