SCHEMBL9312943

SCHEMBL9312943

CC=CCNC(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
MMP8 P22894 1/20 0.31
ANPEP P15144 1/20 0.31
LAP3 P28838 1/20 0.30
FDPS P14324 1/20 0.30

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
SCHEMBL8915375 0.70 FNTA (0.62)
SCHEMBL19348652 0.68
SCHEMBL19348654 0.68
SCHEMBL251354 0.67
SCHEMBL9629113 0.67 FDPS (0.42) CA12CA1MMP8ANPEPLAP3
SCHEMBL4610664 0.67
SCHEMBL9304156 0.67 ALDH1A1 (0.39)
SCHEMBL731378 0.66 MMP2 (0.39) CA12CA1MMP8ANPEPLAP3
SCHEMBL20921214 0.64 CA14 (0.41) CA12
(Propylamino)Methylenediphosphonic Acid SCHEMBL8817761 0.64 MMP2 (0.50) ANPEPLAP3FDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5302677-A Scale inhibitors, complexing agents, detergent builders HOECHST AKTIENGESELLSCHAFT (DE) 1994-04-12 US disclosed