SCHEMBL6570236

SCHEMBL6570236

Oc1ccc(-n2nn[nH]c2=S)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.36
TYMP P19971 1/20 0.34
ESR2 Q92731 2/20 0.34
ALDH1A1 P00352 4/20 0.34
KDM4E B2RXH2 3/20 0.34
HPGD P15428 2/20 0.34
PKM P14618 1/20 0.34
KMT2A Q03164 3/20 0.33
GAA P10253 2/20 0.33
MEN1 O00255 2/20 0.33
ADORA3 P0DMS8 2/20 0.33
ADORA1 P30542 2/20 0.33
LMNA P02545 1/20 0.33
GFER P55789 1/20 0.33
ADORA2A P29274 1/20 0.33
ESR1 P03372 1/20 0.33
HTT P42858 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HSD17B10 Q99714 1/20 0.33
APAF1 O14727 1/20 0.32

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
SCHEMBL1250161 0.81 KDM4E (0.46) MAPTALDH1A1KDM4EHPGDKMT2A
SCHEMBL9750203 0.78 TSHR (0.50) MAPTALDH1A1HPGDKMT2A
SCHEMBL8049848 0.77 ALDH1A1 (0.44) MAPTALDH1A1KDM4EHPGDKMT2A
SCHEMBL1247788 0.77 HPGD (0.47) MAPTALDH1A1KDM4EHPGDKMT2A
SCHEMBL12892330 0.77 ALDH1A1 (0.42) MAPTALDH1A1KDM4EPKMKMT2A
SCHEMBL10519733 0.75 CA9 (0.41) MAPTALDH1A1KDM4EHPGDKMT2A
SCHEMBL8710433 0.73 SMN1; SMN2 (0.49) MAPTALDH1A1KDM4EHPGDKMT2A
SCHEMBL10782734 0.68 TSHR (0.44) MAPTALDH1A1KDM4EHPGDPKM
SCHEMBL14557318 0.65 TSHR (0.37) MAPTESR2ALDH1A1KDM4EPKM
SCHEMBL9427819 0.65 TDP1 (0.64) MAPTESR2ALDH1A1PKMKMT2A

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-0925527-B1 PHOTOGRAPHIC ELEMENT AND METHOD POLAROID CORP (US) 2004-04-14 EP disclosed