SCHEMBL9506705

SCHEMBL9506705

CC(C(=O)O)N(C)P(=O)(O)O.[NaH]

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.33
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP8 P22894 1/20 0.30
CA9 Q16790 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
SCHEMBL4437316 0.98 TP53 (0.35) TP53CA12CA1CA2MMP1
Phosphoric Acid SCHEMBL27662638 0.75 TP53 (0.36) TP53CA12CA1CA2MMP1
SCHEMBL5022986 0.75 TP53 (0.36) TP53CA12CA1CA2MMP1
SCHEMBL9011339 0.75 TP53 (0.36) TP53CA12CA1CA2MMP1
SCHEMBL4441402 0.74 ADAMTS4 (0.34) TP53
SCHEMBL9506709 0.74 CA2 (0.31) CA2
SCHEMBL10764185 0.71 TP53 (0.33) TP53CA12CA1CA2MMP1
SCHEMBL11657118 0.71
SCHEMBL22164139 0.71
SCHEMBL6227204 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0281103-B1 PHENOXYCARBOXYLIC ACID COMPOUNDS AND HERBICIDE COMPRISING IT AS ACTIVE INGREDIENT TEIJIN LIMITED (JP) 1993-06-23 EP disclosed
EP-0533925-A1 OPTICAL ISOMER OF R-FORM OF DIPHENYL ETHER DERIVATIVE AND HERBICIDE CONTAINING THE SAME AS ACTIVE INGREDIENT TEIJIN LIMITED (JP) 1993-03-31 EP disclosed
EP-0442172-A1 Oxime derivatives and Herbicides containing the same as an active ingredient TEIJIN LIMITED (JP) 1991-08-21 EP disclosed
US-4845264-A PRE- AND POST-EMERGENCE FOR BROAD-LEAVED WEEDS TEIJIN LIMITED (JP) 1989-07-04 US disclosed
EP-0281103-A2 Phenoxycarboxylic acid compounds and herbicide comprising it as active ingredient TEIJIN LIMITED (JP) 1988-09-07 EP disclosed