SCHEMBL9772400

SCHEMBL9772400

CCN(CC)OP(=O)(O)Cl

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FDPS P14324 2/20 0.36
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MMP8 P22894 1/20 0.36
TP53 P04637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL9839912 0.79 TP53 (0.38) TP53TDP1
SCHEMBL11011502 0.79 TP53 (0.43) TP53TDP1
SCHEMBL566174 0.79 FDPS (0.39) FDPSMMP1MMP2MMP3MMP8
SCHEMBL28061503 0.77 FDPS (0.37) FDPSMMP1MMP2MMP3MMP8
SCHEMBL5953931 0.77 FDPS (0.37) FDPSMMP1MMP2MMP3MMP8
Ethylene SCHEMBL28834773 0.75 FDPS (0.36) FDPSMMP1MMP2MMP3MMP8
SCHEMBL9328046 0.71 TSHR (0.40) FDPSMMP1MMP2MMP3MMP8
SCHEMBL9483293 0.71 BTN3A1 (0.39) FDPSMMP1MMP2MMP3MMP8
SCHEMBL9280310 0.70 TSHR (0.30)
SCHEMBL16597718 0.70

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
JP-3020290-A None JP disclosed
JP-H0320290-A 2,2'-BIS(DI(M-TOLYL)PHOSPHINO)-1,1'-BINAPHTHYL TAKASAGO INTERNATL CORP 1991-01-29 JP disclosed