SCHEMBL6645249

SCHEMBL6645249

CCOC(=O)C(C(=O)OCC)c1ncc(C)cc1[N+](=O)[O-]

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
L3MBTL1 Q9Y468 3/20 0.40
MAPT P10636 6/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
GPR35 Q9HC97 1/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 3/20 0.39
GALR2 O43603 1/20 0.39
MITF O75030 1/20 0.39
POLB P06746 1/20 0.39
HSP90AA1 P07900 1/20 0.39
HPGD P15428 1/20 0.39
XBP1 P17861 1/20 0.39
CCR6 P51684 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CYP1A2 P05177 2/20 0.38
CYP2C9 P11712 2/20 0.38

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
SCHEMBL25338637 0.95 ALDH1A1 (0.45) ALDH1A1SMN1; SMN2L3MBTL1MAPTCRHBP
SCHEMBL23830347 0.92 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2L3MBTL1MAPTCRHBP
SCHEMBL26767956 0.90 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2MAPTGPR35KMT2A
SCHEMBL29923851 0.86 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2L3MBTL1MAPTCRHBP
SCHEMBL8656016 0.86 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2L3MBTL1MAPTCRHBP
SCHEMBL30468543 0.86 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2L3MBTL1MAPTCRHBP
SCHEMBL1621780 0.86 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2L3MBTL1MAPTCRHBP
SCHEMBL8656095 0.86 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2L3MBTL1MAPTCRHBP
SCHEMBL20594744 0.83 ALDH1A1 (0.50) ALDH1A1L3MBTL1MAPTCRHBPCRHR2
SCHEMBL17446891 0.81 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2L3MBTL1MAPTCRHBP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250171432-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2025-05-29 US disclosed
EP-4469447-A1 COMPOUNDS AND METHODS OF USE Tango Therapeutics, Inc. (US) 2024-12-04 EP disclosed
WO-2023146989-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 WO disclosed
EP-1453831-A1 1H-PYRROLO(3,2-B)PYRIDINE-3-CARBOXYLIC ACID AMIDES Neurogen Corporation (US) 2004-09-08 EP disclosed
US-6673811-B1 TREATMENT OF ANXIETY, DEPRESSION, SLEEP DISORDER, ATTENTION DEFICIT DISORDER, ALZHEIMER'S DEMENTIA, OR SHORT-TERM MEMORY LOSS NEUROGEN CORPORATION 2004-01-06 US disclosed
WO-2003044018-A1 1H-PYRROLO[3,2-B]PYRIDINE-3-CARBOXYLIC ACID AMIDES NEUROGEN CORPORATION (US) 2003-05-30 WO 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 (1 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-20250171432-A1 COMPOUNDS AND METHODS OF USE ABCG2, F12, CYP2C9 ALDH1A1 181/4885SMN1; SMN2 1175/4885L3MBTL1 2983/4885

“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.