SCHEMBL9702695

SCHEMBL9702695

CCOC(=O)C(C(=S)NCc1ccccn1)c1ccccn1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
GAA P10253 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
RAB9A P51151 2/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 2/20 0.47
LMNA P02545 1/20 0.47
ALOX15 P16050 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
HPGD P15428 2/20 0.45
HSD17B10 Q99714 1/20 0.45
NPC1 O15118 1/20 0.44

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
SCHEMBL9703145 0.89 SMN1; SMN2 (0.54) ALDH1A1SMN1; SMN2GAAMEN1KMT2A
SCHEMBL9703922 0.88 MEN1 (0.49) ALDH1A1SMN1; SMN2GAAMEN1KMT2A
SCHEMBL9703137 0.86 KMT2A (0.47) ALDH1A1SMN1; SMN2GAAMEN1KMT2A
SCHEMBL9703141 0.86 KMT2A (0.47) ALDH1A1SMN1; SMN2GAAMEN1KMT2A
SCHEMBL9704867 0.86 KMT2A (0.47) ALDH1A1SMN1; SMN2GAAMEN1KMT2A
SCHEMBL9702851 0.85 SMN1; SMN2 (0.51) ALDH1A1SMN1; SMN2GAAMEN1KMT2A
SCHEMBL9703901 0.84 SMN1; SMN2 (0.54) ALDH1A1SMN1; SMN2GAAMEN1KMT2A
SCHEMBL9702676 0.82 SMN1; SMN2 (0.48) ALDH1A1SMN1; SMN2GAAMEN1KMT2A
SCHEMBL9704884 0.82 SMN1; SMN2 (0.48) ALDH1A1SMN1; SMN2GAAMEN1KMT2A
SCHEMBL9702660 0.81 SMN1; SMN2 (0.51) ALDH1A1SMN1; SMN2GAAMEN1KMT2A

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-0223512-B1 2-PYRIDYLACETIC ACID DERIVATIVE, PREPARATION PROCESS THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME SUNTORY LIMITED (JP) 1992-07-08 EP disclosed
US-4738977-A 2-pyridylacetic acid derivatives, pharmaceutical composition containing the same and their use in treating ulcers SUNTORY LIMITED (JP) 1988-04-19 US disclosed