SCHEMBL4650753

SCHEMBL4650753

Cn1c(=O)c2c(ncn2CO)n(C)c1=O

nearest known ligand 0.79

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADORA2B P29275 11/20 0.79
LMNA P02545 3/20 0.79
MAPT P10636 1/20 0.69
SMN1; SMN2 Q16637 4/20 0.69
POLB P06746 1/20 0.69
RXFP1 Q9HBX9 2/20 0.63
MAPK1 P28482 1/20 0.63
KMT2A Q03164 1/20 0.63

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
Etofylline SCHEMBL149271 0.89 ADORA2B (1.00) ADORA2BLMNAMAPTSMN1; SMN2POLB
SCHEMBL16120984 0.88 ADORA2B (0.81) ADORA2BLMNAMAPTSMN1; SMN2POLB
SCHEMBL19533057 0.86 ADORA2B (0.73) ADORA2BLMNAMAPTSMN1; SMN2POLB
SCHEMBL9293406 0.86 ADORA2B (0.83) ADORA2BLMNAMAPTSMN1; SMN2POLB
SCHEMBL16120979 0.85 ADORA2B (0.85) ADORA2BLMNAMAPTSMN1; SMN2POLB
SCHEMBL516014 0.85 ADORA2B (0.72) ADORA2BLMNAMAPTSMN1; SMN2POLB
SCHEMBL16120975 0.85 ADORA2B (0.88) ADORA2BLMNAMAPTSMN1; SMN2POLB
SCHEMBL19370573 0.85 ADORA2B (0.71) ADORA2BLMNAMAPTSMN1; SMN2POLB
SCHEMBL8697228 0.84 ADORA2B (0.81) ADORA2BLMNAMAPTSMN1; SMN2POLB
SCHEMBL8666393 0.83 ADORA2B (0.79) ADORA2BLMNAMAPTSMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0502043-B1 UTILIZATION OF XANTHINES, OPTIONALLY INCORPORATED IN LIPOSOMES IN ORDER TO HELP THE PIGMENTATION OF SKIN OR HAIR LVMH RECH (FR) 1995-03-01 EP claimed
EP-0502043-A1 UTILIZATION OF XANTHINES, OPTIONALLY INCORPORATED IN LIPOSOMES IN ORDER TO HELP THE PIGMENTATION OF SKIN OR HAIR. LVMH RECH (FR) 1992-09-09 EP claimed
WO-1991007945-A1 UTILIZATION OF XANTHINES, OPTIONALLY INCORPORATED IN LIPOSOMES IN ORDER TO HELP THE PIGMENTATION OF SKIN OR HAIR LVMH RECHERCHE (FR) 1991-06-13 WO claimed
US-9649381-B2 Transporter protein-coupled nanodevices for targeted drug delivery WAYNE STATE UNIVERSITY (US) 2017-05-16 US disclosed
US-20150125926-A1 TRANSPORTER PROTEIN-COUPLED NANODEVICES FOR TARGETED DRUG DELIVERY NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-05-07 US disclosed
EP-1904020-A2 NEW SLIMMING COSMETIC COMPOSITIONS Sederma S.A.S. (FR) 2008-04-02 EP disclosed
WO-2007010478-A2 SLIMMING COSMETIC COMPOSITIONS SEDERMA (FR) 2007-01-25 WO disclosed
US-5470579-A Xanthines, optionally incorporated in liposomes, for promoting skin or hair pigmentation LVMH, RECHERCHE (FR) 1995-11-28 US disclosed
EP-0502043-B1 UTILIZATION OF XANTHINES, OPTIONALLY INCORPORATED IN LIPOSOMES IN ORDER TO HELP THE PIGMENTATION OF SKIN OR HAIR LVMH RECH (FR) 1995-03-01 EP disclosed
EP-0502043-A1 UTILIZATION OF XANTHINES, OPTIONALLY INCORPORATED IN LIPOSOMES IN ORDER TO HELP THE PIGMENTATION OF SKIN OR HAIR. LVMH RECH (FR) 1992-09-09 EP disclosed
WO-1991007945-A1 UTILIZATION OF XANTHINES, OPTIONALLY INCORPORATED IN LIPOSOMES IN ORDER TO HELP THE PIGMENTATION OF SKIN OR HAIR LVMH RECHERCHE (FR) 1991-06-13 WO disclosed
WO-1990008128-A1 NOVEL PRODRUG DERIVATIVES OF BIOLOGICALLY ACTIVE AGENTS CONTAINING HYDROXYL GROUPS OR NH-ACIDIC GROUPS BUNDGAARD HANS (DK) 1990-07-26 WO disclosed
US-4845081-A PRODRUGS, URACILS UNIVERSITY OF FLORIDA (US) 1989-07-04 US disclosed
EP-0189101-A3 COMPOUNDS HAVING MUCOLYTIC AND BRONCHODILATING ACTIVITY, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITION CONTAINING THEM AS ACTIVE PRINCIPLE PROTER S.p.A. (IT) 1987-10-14 EP disclosed
US-4614811-A REACTING BARIUM SALT OF AMINOMALONIC ACID WITH PLATINUM SULFATE AMINO INTERMEDIATE YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM (IL) 1986-09-30 US disclosed
EP-0189101-A2 Compounds having mucolytic and bronchodilating activity, a process for their preparation and pharmaceutical composition containing them as active principle PROTER S.p.A. (IT) 1986-07-30 EP disclosed
EP-0189101-A2 Compounds having mucolytic and bronchodilating activity, a process for their preparation and pharmaceutical composition containing them as active principle PROTER S.p.A. (IT) 1986-07-30 EP disclosed
US-4275064-A Transient pro-drug forms of xanthine derivatives and their use as topical anti-inflammatory agents INTERX RESEARCH CORPORATION (US) 1981-06-23 US disclosed
US-4061753-A Treating psoriasis with transient pro-drug forms of xanthine derivatives INTERX RESEARCH CORPORATION (US) 1977-12-06 US disclosed
US-4045567-A 2-Alkyl-5-thiazole-carboxylic acid derivatives in hypolipemiant compositions ROUSSEL UCLAF (FR) 1977-08-30 US disclosed