SCHEMBL1822007

SCHEMBL1822007

CC(=O)CCCCN1CN(C)c2c1n(C)c(=O)[nH]c2=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PAOX Q6QHF9 1/20 0.34
▸ RXFP1 Q9HBX9 2/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ CYP1A2 P05177 5/20 0.33
▸ PDE4A P27815 3/20 0.33
▸ PDE4B Q07343 2/20 0.33
▸ PDE4C Q08493 2/20 0.33
▸ PDE4D Q08499 2/20 0.33
▸ LMNA P02545 2/20 0.33
▸ NFKB1 P19838 2/20 0.33
▸ ACHE P22303 2/20 0.33
▸ PMP22 Q01453 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ CYP2C9 P11712 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ USP2 O75604 1/20 0.33
▸ TNF P01375 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ ADORA2B P29275 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL9394694 0.99 PAOX (0.36) PAOXRXFP1MAPK1CYP1A2PDE4A
SCHEMBL9395069 0.99 PAOX (0.36) PAOXRXFP1MAPK1CYP1A2PDE4A
SCHEMBL9116975 0.99 PAOX (0.36) PAOXRXFP1MAPK1CYP1A2PDE4A
SCHEMBL8002920 0.86 — —
SCHEMBL5093692 0.86 PDE4A (0.34) PAOXRXFP1MAPK1CYP1A2PDE4A
SCHEMBL7745867 0.85 KDM4E (0.36) MAPK1CYP1A2CYP2C19GAATDP1
SCHEMBL9392011 0.85 KMT2A (0.38) MAPK1CYP1A2LMNAMAPTCYP2C9
SCHEMBL9171913 0.84 CYP2C9 (0.33) PAOXCYP1A2MAPTCYP2C9KMT2A
SCHEMBL8952586 0.84 KDM4E (0.36) MAPK1LMNAMAPTCYP2C9KMT2A
SCHEMBL8952620 0.84 KDM4E (0.36) MAPK1LMNAMAPTCYP2C9KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016004212-A1 HYDROGELS FOR TREATING AND AMELIORATING WOUNDS AND METHODS FOR MAKING AND USING THEM VICUS THERAPEUTICS, LLC (US) 2016-01-07 — — WO claimed
EP-2490702-A1 TREATMENT USING REPROGRAMMED MATURE ADULT CELLS Tristem Trading (Cyprus) Limited (CY) 2012-08-29 — — EP claimed
EP-2259844-A1 COMPOSITIONS AND METHODS FOR MUCOSITIS AND ONCOLOGY THERAPIES Vicus Therapeutics SPE 1, LLC (US) 2010-12-15 — — EP claimed
WO-2009111648-A1 COMPOSITIONS AND METHODS FOR MUCOSITIS AND ONCOLOGY THERAPIES VICUS THERAPEUTICS, LLC (US) 2009-09-11 — — WO claimed
WO-2009097095-A2 METHODS FOR TREATING HEMATOPOIETIC MALIGNANCIES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-08-06 — — WO claimed
WO-2008033754-A2 XANTHINE DERIVATIVES IN METHODS AND COMPOSITIONS FOR THE TREATMENT OF VASCULAR DEPRESSION DUKE UNIVERSITY (US) 2008-03-20 — — WO claimed
WO-2001032156-A2 METHODS FOR TREATING FIBROPROLIFERATIVE DISEASES DALHOUSIE UNIVERSITY (CA) 2001-05-10 — — WO claimed
WO-1992007585-A1 THE USE OF ANTIBODIES TO TNF OR FRAGMENTS DERIVED THEREOF AND XANTHINE DERIVATIVES FOR COMBINATION THERAPY AND COMPOSITIONS THEREFOR CELLTECH LIMITED (GB) 1992-05-14 — — WO claimed
WO-2023283631-A2 METHODS FOR DIFFERENTIATING AND SCREENING STEM CELLS THE BROAD INSTITUTE, INC. (US) 2023-01-12 — — WO disclosed
WO-2020189538-A1 STORAGE LIQUID FOR MAMMALIAN CELLS 株式会社メガカリオン 2020-09-24 — — WO disclosed
EP-3638244-A1 PHARMACEUTICAL FORMULATIONS OF XANTHINE OR XANTHINE DERIVATIVES, AND THEIR USE Harrow IP, LLC (US) 2020-04-22 — — EP disclosed
WO-2020069005-A1 PHARMACEUTICAL COMPOSITIONS FOR PREVENTION OR TREATMENT OF CYTOKINE RELEASE SYNDROME HARROW HEALTH, INC. (US) 2020-04-02 — — WO disclosed
EP-3472190-A1 FIBRONECTIN-BINDING PEPTIDES FOR USE IN TUMOR OR FIBROSIS DIAGNOSIS AND THERAPY ETH Zurich (CH) 2019-04-24 — — EP disclosed
WO-2018231739-A1 PHARMACEUTICAL FORMULATIONS OF XANTHINE OR XANTHINE DERIVATIVES, AND THEIR USE ETON PHARMACEUTICALS, INC. (US) 2018-12-20 — — WO disclosed
EP-0584347-A1 ENANTIOMERIC HYDROXYLATED XANTHINE COMPOUNDS CELL THERAPEUTICS, INC. (US) 1994-03-02 — — EP disclosed
WO-1993017684-A2 ENANTIOMERIC HYDROXYLATED XANTHINE COMPOUNDS CELL THERAPEUTICS, INC. (US) 1993-09-16 — — WO disclosed
WO-1992007585-A1 THE USE OF ANTIBODIES TO TNF OR FRAGMENTS DERIVED THEREOF AND XANTHINE DERIVATIVES FOR COMBINATION THERAPY AND COMPOSITIONS THEREFOR CELLTECH LIMITED (GB) 1992-05-14 — — WO disclosed
EP-0252487-B1 PACKAGE CONTAINING DRUG COMBINATIONS FOR SUCCESSIVE ADMINISTRATION HOECHST AKTIENGESELLSCHAFT (DE) 1991-05-08 — — EP disclosed
EP-0252487-A2 Package containing drug combinations for successive administration HOECHST AKTIENGESELLSCHAFT (DE) 1988-01-13 — — EP disclosed
EP-0157098-A1 Xanthine derivatives, pharmaceuticals compositions containing them and a process for their preparation Beecham Wuelfing GmbH & Co KG (DE) 1985-10-09 — — EP disclosed
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