SCHEMBL11039893

SCHEMBL11039893

O=C(CI)NNc1ccc(NC(=O)Nc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.58
MAOB P27338 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.57
TP53 P04637 2/20 0.57
EPHX1 P07099 1/20 0.57
TSHR P16473 1/20 0.57
EPHX2 P34913 1/20 0.57
CDK9 P50750 1/20 0.57
CLK4 Q9HAZ1 1/20 0.57
NPC1 O15118 5/20 0.56
RAB9A P51151 5/20 0.56
KMT2A Q03164 4/20 0.56
TAAR1 Q96RJ0 3/20 0.56
CASP3 P42574 1/20 0.55
SENP7 Q9BQF6 1/20 0.55
ALOX5 P09917 1/20 0.51
SIRT1 Q96EB6 1/20 0.50
GAA P10253 1/20 0.50
HIF1A Q16665 1/20 0.49
MEN1 O00255 3/20 0.49

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
SCHEMBL10771609 0.89 ALOX5 (0.61) SMN1; SMN2TSHRALOX5GAAALDH1A1
SCHEMBL11047148 0.81 MAOA (0.63) MAOAMAOBSMN1; SMN2TP53EPHX1
SCHEMBL13648229 0.78 SMN1; SMN2 (0.70) MAOAMAOBSMN1; SMN2TP53EPHX1
SCHEMBL2688879 0.78 EPHX2 (0.61) SMN1; SMN2TP53EPHX1TSHREPHX2
SCHEMBL11059378 0.78 SMN1; SMN2 (0.94) MAOAMAOBSMN1; SMN2TP53EPHX1
SCHEMBL10906841 0.77 TSHR (0.78) MAOAMAOBSMN1; SMN2TP53EPHX1
SCHEMBL6833118 0.76 EPHX2 (0.59) SMN1; SMN2TP53EPHX1TSHREPHX2
SCHEMBL10906039 0.76 PTGS2 (0.79) MAOAMAOBSMN1; SMN2TP53EPHX1
SCHEMBL13042440 0.76 ALOX5 (0.68) SMN1; SMN2TSHRALOX5GAAALDH1A1
Diphenylurea SCHEMBL133103 0.75 SMN1; SMN2 (1.00) MAOAMAOBSMN1; SMN2TP53EPHX1

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-4481285-A IMPROVED SHAPPNESS AND EDGE EFFECTS FUJI PHOTO FILM CO., LTD. (JP) 1984-11-06 US disclosed