SCHEMBL8316276

SCHEMBL8316276

N/N=C(/c1ccc(Cl)cc1)c1ccccc1N

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.49
GFER P55789 1/20 0.49
KMT2A Q03164 1/20 0.49
MGLL Q99685 1/20 0.43
RECQL P46063 1/20 0.40
NR4A1 P22736 1/20 0.40
MAPT P10636 2/20 0.39
GAA P10253 1/20 0.39
RAB9A P51151 2/20 0.39
HPGD P15428 2/20 0.39
KDM4E B2RXH2 1/20 0.39
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
FADS1 O60427 1/20 0.38
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37

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
SCHEMBL9853483 0.85 MAPT (0.53) SMN1; SMN2GFERKMT2AMAPTGAA
SCHEMBL9853492 0.79 SMN1; SMN2 (0.77) SMN1; SMN2GFERKMT2ARECQLMAPT
SCHEMBL6181273 0.78 ESR1 (0.48) SMN1; SMN2MAPTRAB9AHPGDKDM4E
SCHEMBL332626 0.74 MAPT (0.71) SMN1; SMN2KMT2AMGLLRECQLNR4A1
SCHEMBL29963430 0.74 MAPT (0.71) SMN1; SMN2KMT2AMGLLRECQLNR4A1
SCHEMBL28575134 0.74 MGLL (0.44) SMN1; SMN2GFERKMT2AMGLLRECQL
SCHEMBL10847877 0.74 SMN1; SMN2 (0.39) SMN1; SMN2GFERKMT2AMGLLRAB9A
SCHEMBL8317995 0.74 RAB9A (0.46) SMN1; SMN2GFERKMT2AMGLLMAPT
SCHEMBL10847875 0.74 SMN1; SMN2 (0.39) SMN1; SMN2GFERKMT2AMGLLRAB9A
SCHEMBL1339690 0.69 GFER (0.64) SMN1; SMN2GFERKMT2AMGLLMAPT

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-0934940-A1 CYTOKINE PRODUCTION INHIBITORS, TRIAZEPINE COMPOUNDS, AND INTERMEDIATES THEREOF Japan Tobacco Inc. (JP) 1999-08-11 EP disclosed
EP-0792880-A1 OSTEOPOROSIS REMEDY AND TRIAZEPINE COMPOUND Japan Tobacco Inc. (JP) 1997-09-03 EP disclosed