SCHEMBL8965153

SCHEMBL8965153

CC(=O)c1ccc(C(=O)NC(N)C(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC1A2 P43004 2/20 0.46
SLC1A3 P43003 1/20 0.45
SLC1A1 P43005 1/20 0.45
CA2 P00918 9/20 0.45
CA1 P00915 4/20 0.45
KIF11 P52732 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
MAPT P10636 2/20 0.42
GRM8 O00222 1/20 0.42
GRM4 Q14833 1/20 0.42
XDH P47989 1/20 0.41
KMT2A Q03164 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
HDAC2 Q92769 1/20 0.40

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
SCHEMBL196586 0.82 SLC1A2 (0.65) SLC1A2CA1SMN1; SMN2MAPTKMT2A
SCHEMBL29408688 0.82 SLC1A2 (0.65) SLC1A2CA1SMN1; SMN2MAPTKMT2A
Hydrochloric Acid SCHEMBL27406623 0.81 SLC1A2 (0.62) SLC1A2CA1SMN1; SMN2MAPTKMT2A
SCHEMBL28193079 0.81 SLC1A2 (0.62) SLC1A2CA1SMN1; SMN2MAPTKMT2A
SCHEMBL13753396 0.76 MLYCD (0.61) SMN1; SMN2MAPTXDHKMT2ARAB9A
SCHEMBL25411110 0.74 CA2 (0.64) CA2CA1SMN1; SMN2MAPT
SCHEMBL19392561 0.73 CA2 (0.47) CA2CA1SMN1; SMN2MAPTXDH
SCHEMBL13753440 0.73 NAMPT (0.49) CA2CA1SMN1; SMN2MAPTXDH
SCHEMBL27726231 0.73 SMN1; SMN2 (0.54) SLC1A2CA2CA1SMN1; SMN2KMT2A
SCHEMBL1767668 0.72 CA2 (0.55) CA2CA1

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-5580542-A DETECTING UROGENITAL DISORDER BY ADMINISTERING A P-SUBSTITUTED ANILINE COMPOUNDS KUREHA KAGAKU KOGYO K.K. (JP) 1996-12-03 US disclosed