SCHEMBL9554186

SCHEMBL9554186

CN(CCc1ccccn1)CCC(O)(P(=O)(O)O)P(=O)(O)O

nearest known ligand 0.65

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FDPS P14324 19/20 0.65
GGPS1 O95749 1/20 0.57
KDM4E B2RXH2 1/20 0.48

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
SCHEMBL7941507 0.92 FDPS (0.67) FDPSGGPS1
SCHEMBL9554468 0.91 FDPS (0.67) FDPSGGPS1
SCHEMBL9850898 0.84 FDPS (0.77) FDPSGGPS1
SCHEMBL10622087 0.83 FDPS (0.71) FDPS
SCHEMBL31059181 0.80 KDM4E (0.68) KDM4E
SCHEMBL31059180 0.80 KDM4E (0.68) KDM4E
SCHEMBL12819456 0.80 KDM4E (0.68) KDM4E
SCHEMBL6224728 0.79 FDPS (1.00) FDPSGGPS1
SCHEMBL9161138 0.79 FDPS (0.59) FDPSGGPS1
SCHEMBL9772654 0.78 FDPS (0.65) FDPSGGPS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5190930-A Calcium metabolism disorder CIBA-GEIGY CORPORATION (US) 1993-03-02 US disclosed
US-5110807-A Calcium metabolism disorders CIBA-GEIGY CORPORATION (US) 1992-05-05 US disclosed