SCHEMBL26334694

SCHEMBL26334694

Cc1nc(CC(=O)NI)cs1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.56
MAPT P10636 5/20 0.56
TP53 P04637 2/20 0.56
ALDH1A1 P00352 2/20 0.56
GAA P10253 2/20 0.56
HPGD P15428 1/20 0.56
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
TDP1 Q9NUW8 1/20 0.53
LMNA P02545 2/20 0.52
POLB P06746 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
SLC12A2 P55011 1/20 0.52
SLC12A5 Q9H2X9 1/20 0.52
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
HTT P42858 1/20 0.43

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
SCHEMBL16770015 0.84 SMN1; SMN2 (0.57) SMN1; SMN2MAPTTP53ALDH1A1GAA
SCHEMBL1128988 0.83 SMN1; SMN2 (0.59) SMN1; SMN2MAPTTP53ALDH1A1GAA
SCHEMBL26340909 0.81 PDE5A (0.41) SMN1; SMN2MAPTALDH1A1HPGD
SCHEMBL26334877 0.80 MEN1 (0.41) SMN1; SMN2MAPTTP53ALDH1A1GAA
SCHEMBL16770017 0.80 SMN1; SMN2 (0.57) SMN1; SMN2MAPTTP53ALDH1A1GAA
SCHEMBL26334724 0.79 PDE5A (0.41) SMN1; SMN2TP53
SCHEMBL5544118 0.79 MAPT (0.56) SMN1; SMN2MAPTTP53ALDH1A1GAA
SCHEMBL856450 0.78 GABRA5 (0.61) SMN1; SMN2MAPTTP53ALDH1A1GAA
SCHEMBL7795327 0.78 SMN1; SMN2 (0.58) SMN1; SMN2MAPTTP53ALDH1A1GAA
SCHEMBL26349082 0.78 SLC6A3 (0.42) SMN1; SMN2MAPTTP53ALDH1A1GAA

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