SCHEMBL1666178

SCHEMBL1666178

O=C(Nc1ccc(-n2ncc3cc(Nc4ccc(N5CCC(O)CC5)cc4)ccc32)cc1)c1ccc2c(ccn2CCO)c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK10 P53779 15/20 0.41
MAPK8 P45983 12/20 0.41
MAPK13 O15264 3/20 0.40
MAPK12 P53778 3/20 0.40
MAPK11 Q15759 3/20 0.40
MAPK14 Q16539 3/20 0.40
TNIK Q9UKE5 1/20 0.40
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
POLB P06746 2/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MCL1 Q07820 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
USP2 O75604 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL1665348 0.96 TNIK (0.42) MAPK10MAPK8MAPK13MAPK12MAPK11
SCHEMBL1666179 0.95 MAOB (0.41) MAPK10MAPK8MAPK13MAPK12MAPK11
SCHEMBL1665351 0.93 MAOB (0.42) MAPK10MAPK8MAPK13MAPK12MAPK11
SCHEMBL1664636 0.90 RAB9A (0.45) TNIKNPC1RAB9APOLBMAPT
SCHEMBL1664637 0.90 RAB9A (0.45) TNIKNPC1RAB9APOLBMAPT
SCHEMBL1664617 0.89 MAOB (0.45) MAPK10MAPK8MAPK13MAPK12MAPK11
SCHEMBL1665724 0.86 MAOB (0.47) MAPK10MAPK8MAPK13MAPK12MAPK11
SCHEMBL1663527 0.85 MAPK10 (0.40) MAPK10MAPK8MAPK13MAPK12MAPK11
SCHEMBL1666867 0.85 MAPK10 (0.44) MAPK10MAPK8MAPK13MAPK12MAPK11
SCHEMBL1664619 0.84 MAOB (0.48) MAPK10MAPK8MAPK13MAPK12MAPK11

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
EP-2642994-A2 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS Ligand Pharmaceuticals Incorporated (US) 2013-10-02 EP disclosed
EP-2488486-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES Ligand Pharmaceuticals Inc. (US) 2012-08-22 EP disclosed
WO-2012068406-A2 USE OF HEMATOPOIETIC GROWTH FACTOR MIMETICS LIGAND PHARMACEUTICALS INCORPORATED (US) 2012-05-24 WO disclosed
WO-2011046954-A1 HEMATOPOIETIC GROWTH FACTOR MIMETIC SMALL MOLECULE COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2011-04-21 WO disclosed