SCHEMBL8049640

SCHEMBL8049640

CC(C)CCCCC(O)(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FDPS P14324 19/20 0.61
GGPS1 O95749 8/20 0.61
PDE3A Q14432 3/20 0.52
LMNA P02545 1/20 0.45
ADRB3 P13945 1/20 0.45
PDE4D Q08499 1/20 0.45
AGTR1 P30556 1/20 0.41
OPRM1 P35372 1/20 0.41

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
SCHEMBL14284912 0.96 FDPS (0.59) FDPSGGPS1PDE3ALMNAADRB3
SCHEMBL12570894 0.85 FDPS (0.56) FDPSGGPS1PDE3ALMNAADRB3
SCHEMBL8048683 0.83 FDPS (0.47) FDPSGGPS1PDE3ALMNAADRB3
SCHEMBL15452862 0.82 FDPS (0.76) FDPSGGPS1PDE3ALMNAADRB3
SCHEMBL10403160 0.80 FDPS (0.47) FDPSGGPS1PDE3ALMNAADRB3
SCHEMBL10352125 0.80 FDPS (0.47) FDPSGGPS1PDE3AAGTR1OPRM1
SCHEMBL9313278 0.79 FDPS (0.77) FDPSGGPS1PDE3ALMNAADRB3
SCHEMBL10486933 0.79 GGPS1 (0.61) FDPSGGPS1LMNA
SCHEMBL24383912 0.78 GGPS1 (0.39) FDPSGGPS1LMNA
SCHEMBL9313105 0.77 FDPS (0.74) FDPSGGPS1PDE3ALMNAADRB3

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-0563096-B1 NOVEL METHYLENEBISPHOSPHONIC ACID DERIVATIVES LEIRAS OY (FI) 2000-05-03 EP disclosed
EP-0563096-A1 NOVEL METHYLENEBISPHOSPHONIC ACID DERIVATIVES LEIRAS OY (FI) 1993-10-06 EP disclosed
WO-1992011267-A1 NOVEL METHYLENEBISPHOSPHONIC ACID DERIVATIVES LEIRAS OY (FI) 1992-07-09 WO disclosed
US-4579720-A USING HYDROXYMETHANE DIPHOSPHONIC ACID PLAINS CHEMICAL DEVELOPMENT CO. (US) 1986-04-01 US disclosed
US-4440646-A HYDROXY OR HALOALKANEPHOSPHONATES PLAINS CHEMICAL DEVELOPMENT CO. (US) 1984-04-03 US disclosed
US-4188234-A STABILIZATION OF VINYL POLYMERS, POLYPHOSPHONIC ACID CHELATING AGENT, PROTECTIVE COATINGS PLAINS CHEMICAL DEVELOPMENT CO. (US) 1980-02-12 US disclosed
US-4116990-A OF NON-ALKALI METAL IONS WITH PHOSPHORUS CHELATING COMPOUND PLAINS CHEMICAL DEVELOPMENT CO. (US) 1978-09-26 US disclosed
US-4020091-A TIN SALTS OF POLYPHOSPHONIC ACIDS PLAINS CHEMICAL DEVELOPMENT CO. (US) 1977-04-26 US disclosed