SCHEMBL6280740

SCHEMBL6280740

CCOC(=O)c1nnn(-c2ccccc2)c1C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 1.00
ALOX12 P18054 1/20 1.00
MAPT P10636 1/20 0.68
HTT P42858 2/20 0.68
SLC5A1 P13866 2/20 0.64
SLC5A2 P31639 2/20 0.64
PDE4D Q08499 2/20 0.58
ALDH1A1 P00352 5/20 0.58
HPGD P15428 2/20 0.58
KDM4E B2RXH2 2/20 0.58
KMT2A Q03164 1/20 0.58
HSD17B10 Q99714 1/20 0.58
L3MBTL1 Q9Y468 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.55
PKM P14618 1/20 0.55
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
CYP3A4 P08684 2/20 0.53
CYP2C9 P11712 2/20 0.53
CYP2C19 P33261 2/20 0.53

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
SCHEMBL10374101 0.87 TP53 (0.77) TP53ALOX12MAPTHTTSLC5A1
SCHEMBL10374929 0.86 TP53 (0.75) TP53ALOX12MAPTHTTSLC5A1
SCHEMBL1753520 0.86 TP53 (0.75) TP53ALOX12MAPTHTTSLC5A1
SCHEMBL3402296 0.86 TP53 (0.75) TP53ALOX12MAPTSLC5A1SLC5A2
SCHEMBL15882211 0.85 SMN1; SMN2 (0.77) TP53ALOX12MAPTSLC5A1SLC5A2
SCHEMBL20027621 0.85 TP53 (0.73) TP53ALOX12MAPTHTTSLC5A1
SCHEMBL17321555 0.83 TP53 (0.71) TP53ALOX12MAPTHTTSLC5A1
SCHEMBL23153554 0.82 TP53 (0.70) TP53ALOX12MAPTHTTSLC5A1
SCHEMBL3406954 0.82 ALOX12 (0.69) TP53ALOX12MAPTHTTSLC5A1
SCHEMBL28487777 0.81 TP53 (0.68) TP53ALOX12MAPTHTTSLC5A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025261989-A1 1,2,3-TRIAZOLE DERIVATIVES AS IL4i1 INHIBITORS SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2025-12-26 WO disclosed
US-12384763-B2 Protein and/or peptide modification molecule OSAKA UNIVERSITY (JP) 2025-08-12 US disclosed
WO-2024114680-A9 HETEROCYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION, AND APPLICATION THEREOF 海南先声再明医药股份有限公司 2024-08-15 WO disclosed
WO-2024114680-A1 HETEROCYCLIC COMPOUND, PHARMACEUTICAL COMPOSITION, AND APPLICATION THEREOF 海南先声再明医药股份有限公司 2024-06-06 WO disclosed
US-11691992-B2 Oxaborole analogs and uses thereof ANACOR PHARMACEUTICALS, INC. (US) 2023-07-04 US disclosed
US-11691992-B2 Oxaborole analogs and uses thereof ANACOR PHARMACEUTICALS, INC. (US) 2023-07-04 US disclosed
CN-110642837-B Pyridine amide compound containing triazole or quinolinone structure and application thereof 江西科技师范大学 2023-03-21 CN disclosed
US-20220204481-A1 PROTEIN AND/OR PEPTIDE MODIFICATION MOLECULE OSAKA UNIVERSITY (JP) 2022-06-30 US disclosed
US-20220204481-A1 PROTEIN AND/OR PEPTIDE MODIFICATION MOLECULE OSAKA UNIVERSITY (JP) 2022-06-30 US disclosed
EP-3932912-A1 PROTEIN AND/OR PEPTIDE MODIFICATION MOLECULE Osaka University (JP) 2022-01-05 EP disclosed
US-20150353505-A1 PHTHALAZINONES AND ISOQUINOLINONES AS ROCK INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2015-12-10 US disclosed
EP-2945943-A2 PHTHALAZINONES AND ISOQUINOLINONES AS ROCK INHIBITORS Bristol-Myers Squibb Company (US) 2015-11-25 EP disclosed
WO-2014113620-A2 PHTHALAZINONES AND ISOQUINOLINONES AS ROCK INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2014-07-24 WO disclosed
WO-2014113620-A2 PHTHALAZINONES AND ISOQUINOLINONES AS ROCK INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2014-07-24 WO disclosed
US-6974813-B2 N-[(substituted five-membered di-or triaza diunsaturated ring) carbonyl] guanidine derivatives for the treatment of ischemia WARNER-LAMBERT COMPANY (US) 2005-12-13 US disclosed
JP-2005041879-A N-[(SUBSTITUTED FIVE-MEMBERED DI-OR TRIAZA DIUNSATURATED RING)CARBONYL]GUANIDINE DERIVATIVE FOR TREATMENT OF ISCHEMIA PFIZER PROD INC 2005-02-17 JP disclosed
US-20030149043-A1 N-[(substituted five-membered di-or triaza diunsaturated ring)carbonyl] guanidine derivatives for the treatment of ischemia PFIZER INC. 2003-08-07 US disclosed
US-6492401-B1 SODIUM HYDROGEN EXCHANGER TYPE 1 INHIBITORS; REDUCING PERIOPERATIVE MYOCARDIAL TISSUE DAMAGE PFIZER, INC. 2002-12-10 US disclosed
EP-1056729-A1 N-[(SUBSTITUTED FIVE-MEMBERED DI- OR TRIAZA DIUNSATURATED RING)CARBONYL]GUANIDINE DERIVATIVES FOR THE TREATMENT OF ISCHEMIA Pfizer Products Inc. (US) 2000-12-06 EP disclosed
WO-1999043663-A1 N-[(SUBSTITUTED FIVE-MEMBERED DI- OR TRIAZA DIUNSATURATED RING)CARBONYL] GUANIDINE DERIVATIVES FOR THE TREATMENT OF ISCHEMIA PFIZER PRODUCTS INC. (US) 1999-09-02 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 (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-11691992-B2 Oxaborole analogs and uses thereof OXA1L, EPX, OAT TP53 4500/4885ALOX12 275/4885MAPT 4347/4885
US-20220204481-A1 PROTEIN AND/OR PEPTIDE MODIFICATION MOLECULE PTMS, DNPEP, NPPA TP53 343/4885ALOX12 4413/4885MAPT 624/4885
US-20150353505-A1 PHTHALAZINONES AND ISOQUINOLINONES AS ROCK INHIBITORS MYLK, MYLK2, ROCK1 TP53 1789/4885ALOX12 900/4885MAPT 138/4885
US-20030149043-A1 N-[(substituted five-membered di-or triaza diunsaturated ring)carbonyl] guanidine derivatives for the treatment of ischemia NHERF1, SLC28A1, TNNI3 TP53 4706/4885ALOX12 1166/4885MAPT 4418/4885
US-12384763-B2 Protein and/or peptide modification molecule PTMS, DNPEP, NPPA TP53 343/4885ALOX12 4413/4885MAPT 624/4885

“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.