SCHEMBL5487993

SCHEMBL5487993

O=C(COc1cccc(C(=O)O)c1)NO

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 3/20 0.58
KMT2A Q03164 2/20 0.58
PLA2G4B P0C869 1/20 0.53
MEN1 O00255 1/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
HIF1A Q16665 1/20 0.53
EPAS1 Q99814 1/20 0.53
AKR1C3 P42330 1/20 0.53
SMPD1 P17405 1/20 0.52
POLB P06746 1/20 0.52

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
SCHEMBL4509157 0.86 NR4A2 (0.56) NR4A2KMT2APLA2G4BMEN1NPC1
SCHEMBL4509754 0.86 ALDH1A1 (0.60) NR4A2KMT2APLA2G4BMEN1NPC1
SCHEMBL10167730 0.83 NR4A2 (0.65) NR4A2KMT2APLA2G4BNPC1RAB9A
SCHEMBL5484624 0.83 MEN1 (0.53) KMT2AMEN1POLB
SCHEMBL27248978 0.82 LMNA (0.59) NR4A2KMT2APLA2G4BMEN1NPC1
SCHEMBL21217871 0.82 HSD17B10 (0.56) NR4A2KMT2APLA2G4BMEN1NPC1
SCHEMBL4509438 0.81 NR4A2 (0.51) NR4A2KMT2APLA2G4BMEN1NPC1
SCHEMBL4501978 0.81 NR4A2 (0.51) NR4A2KMT2APLA2G4BMEN1NPC1
SCHEMBL1573336 0.81 KMT2A (0.57) NR4A2KMT2APLA2G4BMEN1NPC1
SCHEMBL4503979 0.81 PRMT5 (0.53) NR4A2KMT2APLA2G4BMEN1NPC1

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
US-20040186081-A1 Naaladase inhibitors for treating opioid tolerance GUILFORD PHARMACEUTICALS INC. 2004-09-23 US claimed
WO-2004078180-A2 NAALADASE INHIBITORS FOR TREATING OPIOID TOLERANCE GUILFORD PHARMACEUTICALS INC. (US) 2004-09-16 WO claimed
EP-1292601-A2 NAALADASE INHIBITORS FOR TREATING RETINAL DISORDERS AND GLAUCOMA GUILFORD PHARMACEUTICALS INC. (US) 2003-03-19 EP claimed
US-20030036534-A1 Naaladase inhibitors for treating retinal disorders and glaucoma EISAI INC. 2003-02-20 US claimed
WO-2001092274-A2 NAALADASE INHIBITORS FOR TREATING RETINAL DISORDERS AND GLAUCOMA GUILFORD PHARMACEUTICALS INC. (US) 2001-12-06 WO claimed
US-7220780-B2 Naaladase inhibitors for treating retinal disorders and glaucoma GUILFORD PHARMACEUTICALS INC. (US) 2007-05-22 US disclosed
US-7220780-B2 Naaladase inhibitors for treating retinal disorders and glaucoma GUILFORD PHARMACEUTICALS INC. (US) 2007-05-22 US disclosed
US-7220780-B2 Naaladase inhibitors for treating retinal disorders and glaucoma GUILFORD PHARMACEUTICALS INC. (US) 2007-05-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040186081-A1 Naaladase inhibitors for treating opioid tolerance OPRD1, OPRK1, OPRM1 NR4A2 3692/4885KMT2A 734/4885PLA2G4B 3539/4885
US-20030036534-A1 Naaladase inhibitors for treating retinal disorders and glaucoma ALDH1A2, GAA, PDE6A NR4A2 3122/4885KMT2A 2857/4885PLA2G4B 949/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.