SCHEMBL5133977

SCHEMBL5133977

COC(=O)c1cccc(CC(C(=O)O)C(=O)NO)c1

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.67
FOLH1 Q04609 2/20 0.58
LOXL2 Q9Y4K0 1/20 0.56
CYP4F2 P78329 2/20 0.55
CYP4A11 Q02928 2/20 0.55
MMP8 P22894 2/20 0.51
HIF1A Q16665 1/20 0.50
MEP1B Q16820 4/20 0.48
MRGPRX4 Q96LA9 1/20 0.46

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
SCHEMBL20168566 0.90 SLC7A5 (0.76) SLC7A5FOLH1LOXL2CYP4F2CYP4A11
SCHEMBL5053124 0.85 FOLH1 (0.63) FOLH1MEP1B
SCHEMBL6687519 0.82 SLC7A5 (0.69) SLC7A5FOLH1LOXL2CYP4F2CYP4A11
SCHEMBL14508897 0.82 SLC7A5 (0.65) SLC7A5FOLH1LOXL2CYP4F2CYP4A11
SCHEMBL7261388 0.80 SLC7A5 (1.00) SLC7A5FOLH1LOXL2CYP4F2CYP4A11
SCHEMBL1790854 0.79 SLC7A5 (0.68) SLC7A5FOLH1LOXL2CYP4F2CYP4A11
Hydrochloric Acid SCHEMBL7261662 0.79 SLC7A5 (0.97) SLC7A5FOLH1LOXL2CYP4F2CYP4A11
SCHEMBL15609287 0.78 SLC7A5 (0.76) SLC7A5FOLH1LOXL2CYP4F2CYP4A11
SCHEMBL13589439 0.78 SLC7A5 (0.76) SLC7A5FOLH1LOXL2CYP4F2CYP4A11
SCHEMBL28281252 0.78 SLC7A5 (0.76) SLC7A5FOLH1LOXL2CYP4F2CYP4A11

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 12 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-20080311037-A1 Compounds which bind PSMA and uses thereof NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2008-12-18 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
US-7220780-B2 Naaladase inhibitors for treating retinal disorders and glaucoma GUILFORD PHARMACEUTICALS INC. (US) 2007-05-22 US disclosed
WO-2006093991-A1 COMPOUNDS WHICH BIND PSMA AND USES THEREOF THE CLEVELAND CLINIC FOUNDATION (US) 2006-09-08 WO disclosed
US-20060009525-A1 Hydroxamic acids and acyl hydroxamines as NAALADase inhibitors GUILFORD PHARMACEUTICALS INC. 2006-01-12 US disclosed
US-6884907-B2 Hydroxamic acids and acyl hydroxamines as naaladase inhibitors GUILFORD PHARMACEUTICALS INC. (US) 2005-04-26 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 (4 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-20080311037-A1 Compounds which bind PSMA and uses thereof FOLH1, PSMA1, BPHL SLC7A5 174/4885FOLH1 1/4885LOXL2 867/4885
US-20040186081-A1 Naaladase inhibitors for treating opioid tolerance OPRD1, OPRK1, OPRM1 SLC7A5 2436/4885FOLH1 254/4885LOXL2 1767/4885
US-20030036534-A1 Naaladase inhibitors for treating retinal disorders and glaucoma ALDH1A2, GAA, PDE6A SLC7A5 3160/4885FOLH1 124/4885LOXL2 1329/4885
US-20060009525-A1 Hydroxamic acids and acyl hydroxamines as NAALADase inhibitors RIMKLA, NAALAD2, NAAA SLC7A5 1371/4885FOLH1 5/4885LOXL2 1285/4885

“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.