SCHEMBL7455412

SCHEMBL7455412

Cn1c(=O)c2c(ncn2CCCP(=O)(O)O)n(C)c1=O

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ADORA2B P29275 10/20 0.68
▸ LMNA P02545 3/20 0.66
▸ MAPK1 P28482 1/20 0.64
▸ RXFP1 Q9HBX9 1/20 0.64
▸ MAPT P10636 1/20 0.62
▸ TSHR P16473 1/20 0.60
▸ SMN1; SMN2 Q16637 3/20 0.58
▸ POLB P06746 1/20 0.55
▸ ALDH1A1 P00352 1/20 0.55

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
SCHEMBL7453920 0.96 ADORA2B (0.69) ADORA2BLMNAMAPK1RXFP1MAPT
SCHEMBL8660276 0.95 ADORA2B (0.67) ADORA2BLMNAMAPK1RXFP1MAPT
SCHEMBL16120975 0.85 ADORA2B (0.88) ADORA2BLMNAMAPK1RXFP1MAPT
SCHEMBL16120979 0.85 ADORA2B (0.85) ADORA2BLMNAMAPK1RXFP1MAPT
SCHEMBL16120983 0.84 ADORA2B (0.85) ADORA2BLMNAMAPK1RXFP1MAPT
SCHEMBL16120982 0.84 ADORA2B (0.85) ADORA2BLMNAMAPK1RXFP1MAPT
SCHEMBL16121000 0.84 ADORA2B (0.85) ADORA2BLMNAMAPK1RXFP1MAPT
SCHEMBL16120989 0.84 ADORA2B (0.85) ADORA2BLMNAMAPK1RXFP1MAPT
SCHEMBL16120999 0.84 ADORA2B (0.85) ADORA2BLMNAMAPK1RXFP1MAPT
SCHEMBL19969384 0.84 ADORA2B (0.85) ADORA2BLMNAMAPK1RXFP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0771813-B1 Alkylxanthine phosphonates and alkylxanthine phosphine oxydes and their use as medicines HOECHST AG (DE) 2002-01-16 — — EP claimed
US-5728686-A TREATMENT OF MUSCULAR DYSTROPHY HOECHST AKTIENGESELLSCHAFT (DE) 1998-03-17 — — US claimed
EP-0771813-A1 Alkylxanthine phosphonates and alkylxanthine phosphine oxydes and their use as medicines HOECHST AKTIENGESELLSCHAFT (DE) 1997-05-07 — — EP claimed
EP-0760811-A1 IMIDAZOLE DERIVATIVES AS HISTAMINE RECEPTOR H 3? (ANT)AGONISTS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1997-03-12 — — EP claimed
EP-0771813-B1 Alkylxanthine phosphonates and alkylxanthine phosphine oxydes and their use as medicines HOECHST AG (DE) 2002-01-16 — — EP disclosed
US-5728686-A TREATMENT OF MUSCULAR DYSTROPHY HOECHST AKTIENGESELLSCHAFT (DE) 1998-03-17 — — US disclosed
EP-0771813-A1 Alkylxanthine phosphonates and alkylxanthine phosphine oxydes and their use as medicines HOECHST AKTIENGESELLSCHAFT (DE) 1997-05-07 — — EP disclosed
EP-0771813-A1 Alkylxanthine phosphonates and alkylxanthine phosphine oxydes and their use as medicines HOECHST AKTIENGESELLSCHAFT (DE) 1997-05-07 — — EP disclosed
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