SCHEMBL389680

SCHEMBL389680

C[C@@H](OC(=O)Oc1ccc([N+](=O)[O-])cc1)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
MGLL Q99685 1/20 0.51
HTR2A P28223 1/20 0.50
GAA P10253 2/20 0.49
BCL9 O00512 1/20 0.47
CTNNB1 P35222 1/20 0.47
MAPT P10636 1/20 0.45
ALOX5 P09917 1/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
FNTA P49354 1/20 0.43
FNTB P49356 1/20 0.43
CES2 O00748 1/20 0.43
CES1 P23141 1/20 0.43

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
SCHEMBL21570247 1.00 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2MGLLHTR2AGAA
SCHEMBL8818613 1.00 ALDH1A1 (0.52) ALDH1A1SMN1; SMN2MGLLHTR2AGAA
SCHEMBL31201617 0.88 HTR2A (0.49) ALDH1A1SMN1; SMN2MGLLHTR2AGAA
SCHEMBL6443753 0.87 MGLL (0.54) ALDH1A1SMN1; SMN2MGLLHTR2AGAA
SCHEMBL30373891 0.86 HTR2A (0.48) ALDH1A1SMN1; SMN2MGLLHTR2AGAA
SCHEMBL1872356 0.86 MGLL (0.53) ALDH1A1SMN1; SMN2MGLLHTR2AGAA
SCHEMBL30374151 0.86 HTR2A (0.48) ALDH1A1SMN1; SMN2MGLLHTR2AGAA
SCHEMBL7311509 0.85 MAPT (0.57) ALDH1A1SMN1; SMN2HTR2AGAAMAPT
SCHEMBL7335038 0.85 MAPT (0.57) ALDH1A1SMN1; SMN2HTR2AGAAMAPT
SCHEMBL8846903 0.83 HCAR2 (0.53) ALDH1A1MGLLGAAMAPTALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4709725-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF Progentos Therapeutics, Inc. (US) 2026-03-18 EP disclosed
US-20250129067-A1 PLATELET-DERIVED GROWTH FACTOR RECEPTOR (PDGFR) ALPHA INHIBITORS AND USES THEREOF PROGENTOS THERAPEUTICS, INC. (US) 2025-04-24 US disclosed
US-20250066341-A1 CYCLOHEXANE ACID DERIVATIVES AS LPA RECEPTOR INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2025-02-27 US disclosed
WO-2024233642-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF PROGENTOS THERAPEUTICS, INC. (US) 2024-11-14 WO disclosed
EP-4430047-A1 PLATELET-DERIVED GROWTH FACTOR RECEPTOR (PDGFR) ALPHA INHIBITORS AND USES THEREOF Progentos Therapeutics, Inc. (US) 2024-09-18 EP disclosed
CN-118475580-A Platelet-derived growth factor receptor (PDGFR) alpha inhibitors and uses thereof 普罗根托斯治疗公司 2024-08-09 CN disclosed
WO-2024076873-A1 HETEROCYCLIC INHIBITORS OF CD73 FOR TREATMENT OF DISEASE TEON THERAPEUTICS, INC. (US) 2024-04-11 WO disclosed
CN-116640117-A Triazole LPAR1 antagonists and uses thereof 武汉人福创新药物研发中心有限公司 2023-08-25 CN disclosed
WO-2023109878-A1 TRIAZASPIRO LPAR1 ANTAGONIST AND USE THEREOF 武汉人福创新药物研发中心有限公司 2023-06-22 WO disclosed
WO-2023081923-A1 PLATELET-DERIVED GROWTH FACTOR RECEPTOR (PDGFR) ALPHA INHIBITORS AND USES THEREOF Frequency Therapeutics, Inc. (US) 2023-05-11 WO disclosed
US-8106232-B2 3-carboxypropyl-aminotetralin derivatives and related compounds as mu opioid receptor antagonists THERAVANCE, INC. (US) 2012-01-31 US disclosed
US-8101794-B2 Crystalline forms of a 3-carboxypropyl-aminotetralin compound THERAVANCE, INC. (US) 2012-01-24 US disclosed
US-8101791-B2 Aminotetralin compounds as mu opioid receptor antagonists THERAVANCE, INC. (US) 2012-01-24 US disclosed
US-8101791-B2 Aminotetralin compounds as mu opioid receptor antagonists THERAVANCE, INC. (US) 2012-01-24 US disclosed
US-8101791-B2 Aminotetralin compounds as mu opioid receptor antagonists THERAVANCE, INC. (US) 2012-01-24 US disclosed
US-20090247627-A1 AMINO- AND AMIDO-AMINOTETRALIN DERIVATIVES AND RELATED COMPOUNDS AS MU OPIOID RECEPTOR ANTAGONISTS THERAVANCE BIOPHARMA R&D IP, LLC 2009-10-01 US disclosed
WO-2009076399-A2 AMINOTETRALIN COMPOUNDS AS MU OPIOID RECEPTOR ANTAGONISTS THERAVANCE, INC. (US) 2009-06-18 WO disclosed
US-20090149465-A1 AMINOTETRALIN COMPOUNDS AS MU OPIOID RECEPTOR ANTAGONISTS THERAVANCE BIOPHARMA R&D IP, LLC 2009-06-11 US disclosed
US-20090149535-A1 3-CARBOXYPROPYL-AMINOTETRALIN DERIVATIVES AND RELATED COMPOUNDS AS MU OPIOID RECEPTOR ANTAGONISTS THERAVANCE BIOPHARMA R&D IP, LLC 2009-06-11 US disclosed
US-20090149465-A1 AMINOTETRALIN COMPOUNDS AS MU OPIOID RECEPTOR ANTAGONISTS THERAVANCE BIOPHARMA R&D IP, LLC 2009-06-11 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 (5 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-20090149465-A1 AMINOTETRALIN COMPOUNDS AS MU OPIOID RECEPTOR ANTAGONISTS OPRL1, OPRM1, OPRK1 ALDH1A1 902/4885SMN1; SMN2 1610/4885MGLL 4233/4885
US-20090149535-A1 3-CARBOXYPROPYL-AMINOTETRALIN DERIVATIVES AND RELATED COMPOUNDS AS MU OPIOID RECEPTOR ANTAGONISTS OPRL1, OPRM1, OPRK1 ALDH1A1 601/4885SMN1; SMN2 2791/4885MGLL 4391/4885
US-20250066341-A1 CYCLOHEXANE ACID DERIVATIVES AS LPA RECEPTOR INHIBITORS LPAR1, LPAR2, LPAR3 ALDH1A1 911/4885SMN1; SMN2 4141/4885MGLL 275/4885
US-20250129067-A1 PLATELET-DERIVED GROWTH FACTOR RECEPTOR (PDGFR) ALPHA INHIBITORS AND USES THEREOF PDGFRB, PDGFRA, PDGFA ALDH1A1 3250/4885SMN1; SMN2 354/4885MGLL 1014/4885
US-20090247627-A1 AMINO- AND AMIDO-AMINOTETRALIN DERIVATIVES AND RELATED COMPOUNDS AS MU OPIOID RECEPTOR ANTAGONISTS OPRL1, OPRM1, OPRD1 ALDH1A1 1590/4885SMN1; SMN2 2035/4885MGLL 4289/4885

“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.