SCHEMBL11035808

SCHEMBL11035808

O=P(O)(O)C(CCO)Sc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 3/20 0.39
ERAP1 Q9NZ08 2/20 0.39
ERAP2 Q6P179 1/20 0.39
SRC P12931 1/20 0.38
ACP3 P15309 2/20 0.38
LAP3 P28838 3/20 0.37
MMP2 P08253 1/20 0.37
MMP8 P22894 1/20 0.37
MMP14 P50281 1/20 0.37
GAA P10253 1/20 0.36
ALDH1A1 P00352 2/20 0.35
CA12 O43570 1/20 0.35
CA9 Q16790 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CFTR P13569 1/20 0.34

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
SCHEMBL9652018 0.72 MMP2 (0.64) ANPEPERAP1ERAP2SRCACP3
SCHEMBL10824975 0.71 TRPA1 (0.41) GAAALDH1A1MEN1KMT2A
SCHEMBL32672505 0.68 TRPA1 (0.43) GAAALDH1A1MEN1KMT2A
SCHEMBL8588591 0.67 MMP2 (0.61) ANPEPSRCACP3LAP3MMP2
SCHEMBL1848023 0.65 ALDH1A1 (0.42) GAAALDH1A1CA12CA9
SCHEMBL18911584 0.65 FFAR1 (0.50) SRCALDH1A1MEN1KMT2ACFTR
SCHEMBL4591759 0.65 FFAR1 (0.50) SRCALDH1A1MEN1KMT2ACFTR
SCHEMBL2455508 0.64 ALDH1A1 (0.53) ALDH1A1
SCHEMBL8842800 0.64 SRC (0.38) ANPEPERAP1ERAP2SRCACP3
Phosphoric Acid SCHEMBL31117107 0.62 HPGD (0.67) SRCALDH1A1CA12CA9MEN1

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-4475943-A Herbicidal α-hydroxy phosphonates MONSANTO COMPANY (US) 1984-10-09 US disclosed
US-4413125-A α-Hydroxy phosphonates MONSANTO COMPANY (US) 1983-11-01 US disclosed