SCHEMBL9703922

SCHEMBL9703922

CCOC(=O)C(C(=S)NCc1ccccc1)c1ccccn1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
GAA P10253 1/20 0.49
PPID Q08752 1/20 0.48
ALDH1A1 P00352 2/20 0.44
EPHX2 P34913 1/20 0.44
PPARG P37231 1/20 0.44
TSHR P16473 1/20 0.43
MAPT P10636 2/20 0.43
PKM P14618 1/20 0.42
POLB P06746 1/20 0.41
MMP8 P22894 1/20 0.41
NAMPT P43490 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 1/20 0.41
ADORA2A P29274 1/20 0.41
ADORA2B P29275 1/20 0.41
CYP1A2 P05177 1/20 0.40

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) MEN1KMT2ASMN1; SMN2GAAALDH1A1
SCHEMBL9702695 0.88 ALDH1A1 (0.49) MEN1KMT2ASMN1; SMN2GAAALDH1A1
SCHEMBL9703141 0.86 KMT2A (0.47) MEN1KMT2ASMN1; SMN2GAAALDH1A1
SCHEMBL9704867 0.86 KMT2A (0.47) MEN1KMT2ASMN1; SMN2GAAALDH1A1
SCHEMBL9703137 0.86 KMT2A (0.47) MEN1KMT2ASMN1; SMN2GAAALDH1A1
SCHEMBL9702851 0.85 SMN1; SMN2 (0.51) MEN1KMT2ASMN1; SMN2GAAALDH1A1
SCHEMBL10746519 0.85 ALDH1A1 (0.45) MEN1KMT2AGAAALDH1A1TSHR
SCHEMBL9703901 0.84 SMN1; SMN2 (0.54) MEN1KMT2ASMN1; SMN2GAAALDH1A1
SCHEMBL9702660 0.83 SMN1; SMN2 (0.51) MEN1KMT2ASMN1; SMN2GAAALDH1A1
SCHEMBL9704884 0.82 SMN1; SMN2 (0.48) MEN1KMT2ASMN1; SMN2GAAALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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
EP-0223512-A2 2-Pyridylacetic acid derivative, preparation process thereof and pharmaceutical composition containing the same SUNTORY LIMITED (JP) 1987-05-27 EP disclosed