SCHEMBL26337388

SCHEMBL26337388

CNC(=O)C1=COCc2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
MAPT P10636 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
GAA P10253 3/20 0.41
KDM4E B2RXH2 3/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
MAOA P21397 2/20 0.38
MAOB P27338 1/20 0.38
FGFR1 P11362 1/20 0.36
FGFR2 P21802 1/20 0.36
FGFR4 P22455 1/20 0.36
FGFR3 P22607 1/20 0.36
HTT P42858 2/20 0.34
PLK1 P53350 1/20 0.33
HPGD P15428 2/20 0.33
HSD17B10 Q99714 2/20 0.33
PRF1 P14222 1/20 0.33
GLA P06280 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL26337411 0.84 MAOA (0.38) ALDH1A1MAPTSMN1; SMN2GAAMAOA
SCHEMBL27655944 0.81 MAOA (0.44) ALDH1A1MAPTSMN1; SMN2GAAKDM4E
SCHEMBL27288131 0.80 MAOA (0.42) ALDH1A1MAPTSMN1; SMN2GAAKDM4E
SCHEMBL21063661 0.78 MAOA (0.41) ALDH1A1MAPTSMN1; SMN2KDM4ERAB9A
Hydrochloric Acid SCHEMBL27286414 0.77 MAOA (0.40) ALDH1A1MAPTSMN1; SMN2KDM4ERAB9A
SCHEMBL28031186 0.75 MAPT (0.44) ALDH1A1MAPTSMN1; SMN2GAAKDM4E
SCHEMBL26421241 0.72 SMN1; SMN2 (0.49) ALDH1A1MAPTSMN1; SMN2GAAKDM4E
SCHEMBL26347539 0.71 SMN1; SMN2 (0.41) ALDH1A1MAPTSMN1; SMN2GAAKDM4E
SCHEMBL26339667 0.71 ALDH1A1 (0.41) ALDH1A1MAPTSMN1; SMN2GAAKDM4E
SCHEMBL5540715 0.67 MAOA (0.43) ALDH1A1MAPTSMN1; SMN2GAAKDM4E

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
EP-4249480-A1 DIPHENYLPYRAZOLE COMPOUND, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Northwest A&F University (CN) 2023-09-27 EP disclosed