SCHEMBL8743154

SCHEMBL8743154

C=CC(=O)NC(=O)Nc1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 6/20 0.71
TP53 P04637 1/20 0.59
EPHX1 P07099 1/20 0.59
TSHR P16473 1/20 0.59
EPHX2 P34913 1/20 0.59
CDK9 P50750 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
CLK4 Q9HAZ1 1/20 0.59
NPC1 O15118 2/20 0.56
RAB9A P51151 2/20 0.56
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
CASP3 P42574 1/20 0.52
SENP7 Q9BQF6 1/20 0.52
MAOA P21397 2/20 0.50
MAOB P27338 2/20 0.50
TAAR1 Q96RJ0 2/20 0.48
SIRT1 Q96EB6 1/20 0.47
ACP1 P24666 1/20 0.47
CYP1A2 P05177 1/20 0.47

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
SCHEMBL19501652 0.85 TGM2 (0.85) TGM2TP53EPHX1TSHREPHX2
SCHEMBL81209 0.84 TGM2 (1.00) TGM2TP53EPHX1TSHREPHX2
SCHEMBL29111221 0.83 TGM2 (0.75) TGM2TP53EPHX1TSHREPHX2
SCHEMBL30211836 0.82 TGM2 (0.96) TGM2TP53EPHX1TSHREPHX2
SCHEMBL28240522 0.82 TGM2 (0.96) TGM2TP53EPHX1TSHREPHX2
SCHEMBL11239798 0.81 TGM2 (0.73) TGM2SMN1; SMN2NPC1RAB9AF13A1
SCHEMBL13134385 0.81 MDM2 (0.62) TGM2EPHX1SMN1; SMN2RAB9AKMT2A
SCHEMBL10401175 0.81 SMN1; SMN2 (0.80) TP53EPHX1TSHREPHX2CDK9
SCHEMBL19501015 0.80 TGM2 (0.70) TGM2TP53EPHX1TSHREPHX2
SCHEMBL19501282 0.80 TGM2 (0.76) TGM2TP53EPHX1TSHREPHX2

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
EP-0751119-A1 A process for preparing acryloyl carbamates or ureas DAINIPPON INK AND CHEMICALS, INC. (JP) 1997-01-02 EP disclosed
US-4332821-A FUNGICIDES ABBOTT LABORATORIES (US) 1982-06-01 US disclosed