SCHEMBL10666376

SCHEMBL10666376

Fc1ccc(-c2nc(N3CCCCC3)c3nc(-c4ccncc4)[nH]c3n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
MAPT P10636 2/20 0.46
MAPK13 O15264 11/20 0.45
MAPK12 P53778 11/20 0.45
MAPK11 Q15759 11/20 0.45
MAPK14 Q16539 11/20 0.45
GCGR P47871 10/20 0.45
PRKD3 O94806 2/20 0.45
MAP4K4 O95819 2/20 0.45
FRK P42685 2/20 0.45
MAPK9 P45984 2/20 0.45
CSNK1A1 P48729 2/20 0.45
CSNK1D P48730 2/20 0.45
GSK3B P49841 2/20 0.45
PTK6 Q13882 2/20 0.45
CLK4 Q9HAZ1 2/20 0.45
PRKD2 Q9BZL6 1/20 0.45
TSHR P16473 2/20 0.44
MEN1 O00255 1/20 0.44
USP2 O75604 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
SCHEMBL10666222 0.99 MAPK13 (0.46) LMNAMAPTMAPK13MAPK12MAPK11
SCHEMBL10867051 0.89 KDM4E (0.48) LMNAMAPTMAPK13MAPK12MAPK11
SCHEMBL10665379 0.88 LMNA (0.57) LMNAMAPTMAPK13MAPK12MAPK11
SCHEMBL10668132 0.87 TSHR (0.56) LMNAMAPTMAPK13MAPK12MAPK11
SCHEMBL10666381 0.82 NPY5R (0.52) LMNAMAPTMAPK13MAPK12MAPK11
SCHEMBL10666227 0.81 NPY5R (0.50) LMNAMAPTMAPK13MAPK12MAPK11
SCHEMBL10666766 0.80 NPY5R (0.51) PRKCINPY5R
SCHEMBL10664793 0.79 ALDH1A1 (0.49) LMNAMAPK13MAPK12MAPK11MAPK14
SCHEMBL10663382 0.78 NPY5R (0.49) PRKCINPY5R
SCHEMBL10662517 0.78 MAPK11 (0.51) LMNAMAPK13MAPK12MAPK11MAPK14

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
US-4728644-A ANTIINFLAMMATORY, ANALGESIC, ANTIPYRETIC YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1988-03-01 US disclosed
EP-0168500-A1 PURINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND MEDICINAL COMPOSITION CONTAINING SAME Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1986-01-22 EP disclosed