SCHEMBL7678092

SCHEMBL7678092

Cc1cc(C(=O)c2ccccc2)ccc1C#CCNc1ccc(C(=N)N)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 4/20 0.40
F10 P00742 2/20 0.40
PLG P00747 1/20 0.40
PLAU P00749 1/20 0.40
PLAT P00750 1/20 0.40
KLK1 P06870 1/20 0.40
KLK5 Q9Y337 1/20 0.40
PRSS1 P07477 9/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
RAB9A P51151 1/20 0.38
PRSS2 P07478 2/20 0.37
PRSS3 P35030 2/20 0.37
TMPRSS6 Q8IU80 2/20 0.37
ST14 Q9Y5Y6 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
LMNA P02545 1/20 0.37
MAPK13 O15264 2/20 0.37
MAPK12 P53778 2/20 0.37
MAPK11 Q15759 2/20 0.37

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
SCHEMBL7669697 0.89 MAPK13 (0.40) F2PRSS1ALDH1A1HPGDRAB9A
SCHEMBL6565690 0.85 PLAU (0.54) F2F10PLGPLAUPLAT
SCHEMBL6565262 0.85 ALDH1A1 (0.45) F2F10PLAUPRSS1ALDH1A1
SCHEMBL6564223 0.84 VNN1 (0.41) F2PLGPLAUPRSS1ALDH1A1
SCHEMBL6563625 0.83 PRSS1 (0.43) F2F10PRSS1ALDH1A1HPGD
SCHEMBL6563277 0.81 F2 (0.41) F2F10PLGPLAUPLAT
SCHEMBL7671074 0.80 F10 (0.43) F2F10PRSS1ALDH1A1HPGD
SCHEMBL6561921 0.79 MAPK13 (0.45) ALDH1A1HPGDRAB9AL3MBTL1LMNA
SCHEMBL6561914 0.78 GRM5 (0.43) F2KLK1KLK5PRSS1ALDH1A1
SCHEMBL6563686 0.77 F10 (0.46) F10ALDH1A1HPGDRAB9A

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-6479524-B1 TO PROLONG THE THROMBIN TIME BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-11-12 US disclosed