SCHEMBL4411652

SCHEMBL4411652

CC(C(=O)NN)c1ncc[nH]1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.43
MMP3 P08254 1/20 0.43
MMP7 P09237 1/20 0.43
FPR2 P25090 9/20 0.43
ADRA2A P08913 2/20 0.40
ADRA2B P18089 2/20 0.40
ADRA2C P18825 2/20 0.40
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
CSNK1A1 P48729 1/20 0.37
TYRO3 Q06418 1/20 0.37
DYRK1B Q9Y463 1/20 0.37
FFAR2 O15552 1/20 0.37
SYK P43405 1/20 0.35
HSPA5 P11021 1/20 0.34
F2RL1 P55085 1/20 0.33

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
SCHEMBL5460567 0.80 CSNK1A1 (0.44) MMP1MMP3MMP7FPR2ADRA2A
SCHEMBL27693248 0.80 FPR2 (0.44) MMP1MMP3MMP7FPR2ADRA2A
SCHEMBL570524 0.78 ADRA2A (0.47) MMP1MMP3MMP7FPR2ADRA2A
SCHEMBL28626525 0.78 FPR2 (0.43) MMP1MMP3MMP7FPR2ADRA2A
SCHEMBL6448258 0.78 FPR2 (0.43) MMP1MMP3MMP7FPR2ADRA2A
SCHEMBL1362893 0.77 FPR2 (0.46) MMP1MMP3MMP7FPR2ADRA2A
Bromide SCHEMBL28219788 0.77 ADRA2A (0.46) MMP1MMP3MMP7FPR2ADRA2A
Hydrochloric Acid SCHEMBL28220351 0.77 ADRA2A (0.46) MMP1MMP3MMP7FPR2ADRA2A
SCHEMBL4552047 0.76 MMP1 (0.35) MMP1MMP3MMP7FPR2ADRA2A
SCHEMBL7438240 0.73 ADRA2A (0.41) MMP1MMP3MMP7FPR2ADRA2A

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
US-7638565-B2 Polyacetal resin composition POLYPLASTICS CO., LTD. (JP) 2009-12-29 US disclosed