SCHEMBL263830

SCHEMBL263830

O=C(O)c1ccc([N+](=O)[O-])c(C(=O)O)c1

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CASP6 P55212 1/20 0.72
TSHR P16473 2/20 0.66
DTYMK P23919 1/20 0.64
LMNA P02545 1/20 0.61
HCAR3 P49019 10/20 0.56
POLB P06746 1/20 0.54
TDP1 Q9NUW8 1/20 0.52
APEX1 P27695 1/20 0.51
TP53 P04637 1/20 0.50

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
SCHEMBL1851121 1.00 CASP6 (0.72) CASP6TSHRDTYMKLMNAHCAR3
SCHEMBL29249351 0.98 CASP6 (0.70) CASP6TSHRDTYMKLMNAHCAR3
SCHEMBL30931540 0.87 DTYMK (0.58) CASP6TSHRDTYMKLMNAHCAR3
SCHEMBL2711636 0.87 DTYMK (0.58) CASP6TSHRDTYMKLMNAHCAR3
SCHEMBL30810715 0.85 CASP6 (0.72) CASP6TSHRLMNAHCAR3POLB
SCHEMBL842661 0.85 CASP6 (0.72) CASP6TSHRLMNAHCAR3POLB
SCHEMBL145092 0.85 CASP6 (0.72) CASP6TSHRLMNAHCAR3POLB
SCHEMBL27680384 0.84 SRD5A2 (0.67) CASP6TSHRLMNAHCAR3POLB
SCHEMBL9199250 0.84 MAPK1 (0.68) CASP6TSHRDTYMKPOLBTDP1
SCHEMBL504055 0.84 CASP6 (1.00) CASP6TSHRLMNAHCAR3APEX1

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 223 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118344743-B High-viscosity modified asphalt and preparation method thereof 南京航空航天大学 2024-11-26 CN claimed
CN-118344743-A High-viscosity modified asphalt and preparation method thereof 南京航空航天大学 2024-07-16 CN claimed
CN-118324640-A Method for recycling 4-nitroisophthalic acid by using mother liquor of 5-nitroisophthalic acid production 江西大宇医药股份有限公司 2024-07-12 CN claimed
CN-118184679-A Photothermal agent and preparation method thereof, photothermal nanoparticle and preparation method thereof, insulating material and self-repairing method of insulating material 中国石油天然气股份有限公司 2024-06-14 CN claimed
CN-117659906-A Packaging adhesive film composition, packaging adhesive film and application 福斯特(滁州)新材料有限公司 2024-03-08 CN claimed
US-20050080139-A1 Naaladase inhibitors for treating huntington's disease GUILFORD PHARMACEUTICALS INC. 2005-04-14 US claimed
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
WO-2003057154-A2 NAALADASE INHIBITORS FOR TREATING HUNTINGTON'S DISEASE GUILDFORD PHARMACEUTICALS INC. (US) 2003-07-17 WO claimed
US-20030083505-A1 Spinal cord injury, demyelinating diseases, Parkinson's disease, Amyotrophic Lateral Sclerosis, alcohol, nicotine, cocaine dependence, neuropathy, pain and schizophrenia; antiischemic, - carcinogenic agents; NAALADase inhibitors EISAI INC. 2003-05-01 US 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
US-6452044-B2 NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDERS GUILFORD PHARMACEUTICALS INC. 2002-09-17 US claimed
US-20020019430-A1 Nervous system and psychological disorders EISAI INC. 2002-02-14 US claimed
US-20020013295-A1 Naaladase inhibitors for treating amyotrophic lateral sclerosis GUILFORD PHARMACEUTICALS INC., A DELAWARE CORPORATION 2002-01-31 US claimed
WO-2001092274-A2 NAALADASE INHIBITORS FOR TREATING RETINAL DISORDERS AND GLAUCOMA GUILFORD PHARMACEUTICALS INC. (US) 2001-12-06 WO claimed
WO-2001091738-A2 NAALADASE INHIBITORS FOR TREATING AMYOTROPHIC LATERAL SCLEROSIS GUILFORD PHARMACEUTICALS INC. (US) 2001-12-06 WO claimed
CN-119530999-B Method for preparing polyetherimide fiber by oxidation method 东营市海科瑞林化工有限公司 2025-06-10 CN disclosed
US-4122119-A Process for the production of unsaturated ketones KURARAY CO., LTD. (JP) 1978-10-24 US disclosed
US-4002664-A Manufacture of dimethylaminobenzenecarboxylic acid esters BASF AKTIENGESELLSCHAFT (DT) 1977-01-11 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 (6 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-20020013295-A1 Naaladase inhibitors for treating amyotrophic lateral sclerosis SMN1; SMN2, GAA, NAALAD2 CASP6 2689/4885TSHR 4825/4885DTYMK 2057/4885
US-20030083505-A1 Spinal cord injury, demyelinating diseases, Parkinson's disease, Amyotrophic Lateral Sclerosis, alcohol, nicotine, cocaine dependence, neuropathy, pain and schizophrenia; antiischemic, - carcinogenic agents; NAALADase inhibitors NGF, GAP43, ACHE CASP6 1862/4885TSHR 4435/4885DTYMK 3251/4885
US-20050080139-A1 Naaladase inhibitors for treating huntington's disease HTT, GAA, ADA CASP6 1840/4885TSHR 3380/4885DTYMK 344/4885
US-20020019430-A1 Nervous system and psychological disorders GLUL, DDC, DNPEP CASP6 855/4885TSHR 4664/4885DTYMK 1992/4885
US-20040186081-A1 Naaladase inhibitors for treating opioid tolerance OPRD1, OPRK1, OPRM1 CASP6 4206/4885TSHR 4169/4885DTYMK 670/4885
US-20030036534-A1 Naaladase inhibitors for treating retinal disorders and glaucoma ALDH1A2, GAA, PDE6A CASP6 2769/4885TSHR 3404/4885DTYMK 1102/4885

“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.