SCHEMBL214847

SCHEMBL214847

Cc1cc(C#N)c(=O)[nH]c1C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.57
HPGD P15428 5/20 0.57
ALDH1A1 P00352 4/20 0.57
GAA P10253 3/20 0.57
GALR3 O60755 1/20 0.57
PDE3A Q14432 5/20 0.54
PDE3B Q13370 4/20 0.54
PDE4A P27815 2/20 0.54
CYP2C19 P33261 2/20 0.54
BLM P54132 2/20 0.54
PDE5A O76074 1/20 0.54
LMNA P02545 1/20 0.54
TSHR P16473 1/20 0.54
PTGS1 P23219 1/20 0.54
PDE4B Q07343 1/20 0.54
PDE4C Q08493 1/20 0.54
PDE4D Q08499 1/20 0.54
RXFP1 Q9HBX9 1/20 0.50
HSD17B10 Q99714 3/20 0.46
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL5091203 0.84 KDM4E (0.58) KDM4EHPGDALDH1A1GAAGALR3
SCHEMBL29472305 0.80 KDM4E (0.54) KDM4EHPGDALDH1A1GAAGALR3
SCHEMBL7345760 0.80 KDM4E (0.54) KDM4EHPGDALDH1A1GAAGALR3
SCHEMBL9265798 0.79 KDM4E (0.53) KDM4EHPGDALDH1A1GAAGALR3
SCHEMBL12354201 0.77 KDM4E (0.44) KDM4EHPGDALDH1A1GAAGALR3
SCHEMBL31297193 0.76 KDM4E (0.50) KDM4EHPGDALDH1A1GAAGALR3
SCHEMBL27224008 0.76 KDM4E (0.50) KDM4EHPGDALDH1A1GAAGALR3
SCHEMBL4739455 0.76 KDM4E (0.56) KDM4EHPGDALDH1A1GAAGALR3
SCHEMBL4514368 0.76 KDM4E (0.50) KDM4EHPGDALDH1A1GAAGALR3
SCHEMBL7521074 0.74 PDE3B (0.58) KDM4EHPGDALDH1A1GAAGALR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118715221-A Tricyclic compounds and uses thereof 希格生科(深圳)有限公司 2024-09-27 CN disclosed
EP-4429663-A1 HETEROCYCLIC COMPOUNDS AS TRIGGERING RECEPTOR EXPRESSED ON MYELOID CELLS 2 AGONISTS Vigil Neuroscience, Inc. (US) 2024-09-18 EP disclosed
WO-2023143354-A1 TRICYCLIC COMPOUND AND APPLICATION THEREOF 希格生科(深圳)有限公司 2023-08-03 WO disclosed
WO-2023086799-A1 HETEROCYCLIC COMPOUNDS AS TRIGGERING RECEPTOR EXPRESSED ON MYELOID CELLS 2 AGONISTS VIGIL NEUROSCIENCE, INC. (US) 2023-05-19 WO disclosed
CN-109320499-B Pyrrole-3-formamide compound and preparation method and application thereof 沈阳药科大学 2020-09-08 CN disclosed
CN-109320499-A Pyrrole-3-carboxamide class compound and its preparation method and application 沈阳药科大学 2019-02-12 CN disclosed
US-9782407-B2 Substituted benzylamino quinolines as cholesterol ester-transfer protein inhibitors DR. REDDY'S LABORATORIES LTD. (IN) 2017-10-10 US disclosed
US-9782407-B2 Substituted benzylamino quinolines as cholesterol ester-transfer protein inhibitors DR. REDDY'S LABORATORIES LTD. (IN) 2017-10-10 US disclosed
US-9782407-B2 Substituted benzylamino quinolines as cholesterol ester-transfer protein inhibitors DR. REDDY'S LABORATORIES LTD. (IN) 2017-10-10 US disclosed
US-9765030-B2 Benzylamine derivatives and their utility as cholesterol ester-transfer protein inhibitors DR. REDDY'S LABORATORIES LTD. (IN) 2017-09-19 US disclosed
US-20060084680-A1 Indane acetic acid derivatives and their use as pharmaceutical agents, intermediates, and method of preparation BAYER PHARMACEUTICALS CORPORATION (US) 2006-04-20 US disclosed
WO-2006035967-A1 PYRIDINE DERIVATIVES AND THEIR USE AS MEDICAMENTS FOR TREATING DISEASES RELATED TO MCH RECEPTOR TAISHO PHARMACEUTICAL CO., LTD. (JP) 2006-04-06 WO disclosed
US-20060052411-A1 Pyridone derivatives having a binding activity to the cannabinoid type 2 receptor TADA YUKIO 2006-03-09 US disclosed
US-6977266-B2 Pyridone derivatives having affinity for cannabinoid 2-type receptor SHIONOGI & CO., LTD. (JP) 2005-12-20 US disclosed
EP-1578715-A2 INDANE ACETIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICAL AGENTS, INTERMEDIATES, AND METHOD OF PREPARATION Bayer Pharmaceuticals Corporation (US) 2005-09-28 EP disclosed
US-20050101590-A1 Cannabinoid receptor agonists SHIONOGI & CO., LTD. (JP) 2005-05-12 US disclosed
EP-1477186-A1 ANTIPRURITICS SHIONOGI & CO., LTD. (JP) 2004-11-17 EP disclosed
WO-2004058174-A2 INDANE ACETIC ACID DERIVATIVES AND THEIR USE AS PHARMACEUTICAL AGENTS, INTERMEDIATES, AND METHOD OF PREPARATION BAYER PHARMACEUTICALS CORPORATION (US) 2004-07-15 WO disclosed
US-20040082619-A1 Pyridone derivatives having affinity for cannabinoid 2-type receptor SHIONOGI & CO., LTD. (JP) 2004-04-29 US disclosed
EP-1357111-A1 PYRIDONE DERIVATIVE HAVING AFFINITY FOR CANNABINOID 2-TYPE RECEPTOR SHIONOGI & CO., LTD. (JP) 2003-10-29 EP 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-20060084680-A1 Indane acetic acid derivatives and their use as pharmaceutical agents, intermediates, and method of preparation INSR, ACACA, IAPP KDM4E 3156/4885HPGD 306/4885ALDH1A1 51/4885
US-20050101590-A1 Cannabinoid receptor agonists CNR1, CNR2, OPRL1 KDM4E 2840/4885HPGD 1692/4885ALDH1A1 4118/4885
US-20060052411-A1 Pyridone derivatives having a binding activity to the cannabinoid type 2 receptor CNR2, CNR1, NPY2R KDM4E 1228/4885HPGD 1872/4885ALDH1A1 2526/4885
US-20040082619-A1 Pyridone derivatives having affinity for cannabinoid 2-type receptor CNR1, CNR2, NPY1R KDM4E 590/4885HPGD 2029/4885ALDH1A1 3084/4885

“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.