SCHEMBL6665992

SCHEMBL6665992

NCCCCCCCCC(O)(P(=O)(O)O)P(=O)(O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FDPS P14324 17/20 1.00
PDE3A Q14432 2/20 0.83
LMNA P02545 2/20 0.67
ADRB3 P13945 1/20 0.67
PDE4D Q08499 1/20 0.67
GGPS1 O95749 6/20 0.63
SMPD1 P17405 2/20 0.45
CYP3A4 P08684 1/20 0.41
NFKB1 P19838 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 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
SCHEMBL328859 1.00 FDPS (1.00) FDPSPDE3ALMNAADRB3PDE4D
Neridronic Acid SCHEMBL87499 1.00 FDPS (1.00) FDPSPDE3ALMNAADRB3PDE4D
SCHEMBL6668742 1.00 FDPS (1.00) FDPSPDE3ALMNAADRB3PDE4D
SCHEMBL328791 1.00 FDPS (1.00) FDPSPDE3ALMNAADRB3PDE4D
SCHEMBL3287859 1.00 FDPS (1.00) FDPSPDE3ALMNAADRB3PDE4D
SCHEMBL12821674 1.00 FDPS (1.00) FDPSPDE3ALMNAADRB3PDE4D
SCHEMBL6667604 1.00 FDPS (1.00) FDPSPDE3ALMNAADRB3PDE4D
Neridronic Acid SCHEMBL328773 0.98 FDPS (0.96) FDPSPDE3ALMNAADRB3PDE4D
Neridronic Acid SCHEMBL10776647 0.98 FDPS (0.96) FDPSPDE3ALMNAADRB3PDE4D
SCHEMBL3411395 0.98 FDPS (1.00) FDPSPDE3ALMNAADRB3PDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140263071-A1 METHOD FOR COLLECTING METALS CHEMEC OY AB (FI) 2014-09-18 US disclosed
EP-2694444-A1 METHOD FOR COLLECTING METALS OY CHEMEC AB (FI) 2014-02-12 EP disclosed
WO-2012131170-A1 METHOD FOR COLLECTING METALS ITÄ-SUOMEN YLIOPISTO (FI) 2012-10-04 WO disclosed
EP-0831845-B1 DIPHOSPHONATE DERIVATIVES OF THERAPEUTIC AGENTS ELIZANOR BIOPHARMACEUTICALS IN (US) 2004-09-08 EP disclosed
US-5854227-A Therapeutic derivatives of diphosphonates ELIZANOR BIOPHARMACUETICALS, INC. 1998-12-29 US disclosed
WO-1996040156-A1 DIPHOSPHONATE DERIVATIVES OF THERAPEUTIC AGENTS ELIZANOR BIOPHARMACEUTICALS, INC. (US) 1996-12-19 WO disclosed