SCHEMBL5597865

SCHEMBL5597865

C=CC(N)CCCCCC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.48
SPHK1 Q9NYA1 2/20 0.45
TSHR P16473 2/20 0.42
CYP2D6 P10635 3/20 0.42
BLM P54132 2/20 0.42
LMNA P02545 2/20 0.42
TP53 P04637 2/20 0.42
LAP3 P28838 2/20 0.42
PLA2G1B P04054 1/20 0.42
PLA2G2A P14555 1/20 0.42
GMNN O75496 1/20 0.42
POLB P06746 1/20 0.42
THPO P40225 1/20 0.42
MTOR P42345 1/20 0.42
KDM4E B2RXH2 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAPT P10636 1/20 0.42
CETP P11597 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL8161427 1.00 OPRM1 (0.48) OPRM1SPHK1TSHRCYP2D6BLM
SCHEMBL5154438 1.00 OPRM1 (0.48) OPRM1SPHK1TSHRCYP2D6BLM
SCHEMBL10685650 1.00 OPRM1 (0.48) OPRM1SPHK1TSHRCYP2D6BLM
SCHEMBL5571899 1.00 OPRM1 (0.48) OPRM1SPHK1TSHRCYP2D6BLM
SCHEMBL4373552 1.00 OPRM1 (0.48) OPRM1SPHK1TSHRCYP2D6BLM
SCHEMBL17770677 1.00 OPRM1 (0.48) OPRM1SPHK1TSHRCYP2D6BLM
SCHEMBL8218531 1.00 OPRM1 (0.48) OPRM1SPHK1TSHRCYP2D6BLM
SCHEMBL7653269 1.00 OPRM1 (0.48) OPRM1SPHK1TSHRCYP2D6BLM
SCHEMBL11219189 1.00 OPRM1 (0.48) OPRM1SPHK1TSHRCYP2D6BLM
Hydrochloric Acid SCHEMBL28609742 0.98 OPRM1 (0.46) OPRM1SPHK1TSHRCYP2D6BLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1189622-B1 ANIONIC POLYMERS AS TOXIN BINDERS AND ANTIBACTERIAL AGENTS GENZYME CORP (US) 2007-07-25 EP claimed
EP-1014999-B1 CATIONIC POLYMERS AS TOXIN-BINDING AGENTS GENZYME CORP (US) 2004-12-08 EP claimed
JP-2002544226-A 2002-12-24 JP claimed
EP-1189622-A2 ANIONIC POLYMERS AS TOXIN BINDERS AND ANTIBACTERIAL AGENTS Geltex Pharmaceuticals, Inc. (US) 2002-03-27 EP claimed
WO-2000069428-A2 ANIONIC POLYMERS AS TOXIN BINDERS AND ANTIBACTERIAL AGENTS GELTEX PHARMACEUTICALS, INC. (US) 2000-11-23 WO claimed
EP-1014999-A1 CATIONIC POLYMERS AS TOXIN-BINDING AGENTS GELTEX PHARMACEUTICALS, INC. (US) 2000-07-05 EP claimed
WO-1999015186-A1 CATIONIC POLYMERS AS TOXIN-BINDING AGENTS GELTEX PHARMACEUTICALS, INC. (US) 1999-04-01 WO claimed
US-20160220512-A1 MODIFIED RELEASE PHARMACEUTICAL FORMULATIONS RUBICON RES PRIVATE LTD (IN) 2016-08-04 US disclosed
EP-1800686-A2 Anionic polymers as toxin binders and antibacterial agents GENZYME CORPORATION (US) 2007-06-27 EP disclosed
US-4256903-A REACTING SULFUR DIOXIDE AND CONJUGATED DIENES IN THE PRESENCE OF A MONO OR DI-ALKENYL AMINE PHILLIPS PETROLEUM COMPANY (US) 1981-03-17 US disclosed