SCHEMBL8522272

SCHEMBL8522272

CCC(CC)C(Br)(CC)P(=O)(O)O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LAP3 P28838 1/20 0.41
FDPS P14324 9/20 0.35
GGPS1 O95749 2/20 0.31
METAP1 P53582 2/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP8 P22894 1/20 0.31
CA9 Q16790 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL5389779 0.79 LAP3 (0.39) LAP3FDPSMETAP1MMP1MMP2
SCHEMBL19211970 0.72 LAP3 (0.40) LAP3FDPSGGPS1CA12CA1
SCHEMBL4828705 0.69 FDPS (0.40) FDPSGGPS1LMNA
SCHEMBL149057 0.67 GCLC (0.33) LAP3FDPSCA12CA1CA2
SCHEMBL4410180 0.65 FDPS (0.37) FDPSGGPS1LMNA
SCHEMBL28440465 0.64 LAP3 (0.43) LAP3FDPSMETAP1
Phosphoric Acid SCHEMBL29043726 0.63
Phosphoric Acid SCHEMBL28448377 0.62 LAP3 (0.60) LAP3FDPSMETAP1
Phosphoric Acid SCHEMBL29275124 0.62 LAP3 (0.60) LAP3FDPSMETAP1
SCHEMBL246809 0.62 FDPS (0.43) FDPSGGPS1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0871985-A4 HETEROLAMELLAR PHOTOVOLTAIC FILMS UNIV PRINCETON (US) 1999-06-09 EP disclosed
EP-0871985-A1 HETEROLAMELLAR PHOTOVOLTAIC FILMS THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1998-10-21 EP disclosed
WO-1997024775-A1 HETEROLAMELLAR PHOTOVOLTAIC FILMS THE TRUSTEES OF PRINCETON UNIVERSITY (US) 1997-07-10 WO disclosed