SCHEMBL9715426

SCHEMBL9715426

Nc1ccccc1N(C=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.35
ALOX15 P16050 2/20 0.35
CASP1 P29466 1/20 0.35
CASP7 P55210 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALDH1A1 P00352 7/20 0.34
MAPT P10636 3/20 0.34
KDM4E B2RXH2 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
GAA P10253 3/20 0.32
HPGD P15428 2/20 0.32
KMT2A Q03164 2/20 0.32
NPC1 O15118 1/20 0.32
LMNA P02545 1/20 0.32
GLA P06280 1/20 0.32

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
SCHEMBL30149971 0.87 CD44 (0.36) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL30149972 0.87 CD44 (0.36) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL6228555 0.85 TDP1 (0.36) CYP3A4ALDH1A1MAPTKDM4ETDP1
SCHEMBL6226289 0.85 MAPK13 (0.35) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL7220722 0.81 PTGS1 (0.40) SMN1; SMN2ALDH1A1MAPTKDM4EL3MBTL1
SCHEMBL23020250 0.80 CYP3A4 (0.35) CYP3A4ALOX15CASP1CASP7SMN1; SMN2
SCHEMBL43388 0.78 ALDH1A1 (0.42) CYP3A4ALOX15ALDH1A1MAPTKDM4E
SCHEMBL5516786 0.78 ALDH1A1 (0.42) CYP3A4ALOX15ALDH1A1MAPTKDM4E
SCHEMBL890760 0.77 NOS3 (0.35) SMN1; SMN2ALDH1A1MAPTKDM4ETDP1
SCHEMBL22879338 0.76 ALDH1A1 (0.39) CYP3A4ALOX15ALDH1A1KMT2ALMNA

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-0304402-B1 ANILINOPHENYL THIOUREAS, ISOTHIOUREAS AND CARBODIIMIDES, THEIR PREPARATION AND THEIR USE IN PEST-CONTROL CIBA-GEIGY AG (CH) 1992-05-06 EP disclosed
EP-0304402-A2 Anilinophenyl thioureas, isothioureas and carbodiimides, their preparation and their use in pest-control CIBA-GEIGY AG (CH) 1989-02-22 EP disclosed