SCHEMBL396193

SCHEMBL396193

Cc1ccc(C(=O)Nc2ccn(C)n2)cc1-c1ccc2c(-c3ccccc3C)nncc2c1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.65
KIT P10721 10/20 0.65
MAPK9 P45984 6/20 0.65
MAPK10 P53779 2/20 0.65
KDR P35968 8/20 0.57
LCK P06239 5/20 0.57
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
CYP3A4 P08684 1/20 0.42
LYN P07948 1/20 0.41
ABL1 P00519 4/20 0.41
GRM5 P41594 1/20 0.41
FGFR1 P11362 1/20 0.39
DDR2 Q16832 1/20 0.39

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
SCHEMBL395444 0.90 MAPK14 (0.53) MAPK14KITMAPK9MAPK10KDR
SCHEMBL396555 0.82 MAPK14 (0.65) MAPK14KITMAPK9MAPK10KDR
SCHEMBL1406087 0.81 MAPK14 (0.73) MAPK14KITMAPK9MAPK10KDR
SCHEMBL396094 0.80 MAPK14 (0.69) MAPK14KITMAPK9MAPK10KDR
SCHEMBL394449 0.80 MAPK14 (0.69) MAPK14KITMAPK9MAPK10KDR
SCHEMBL2953214 0.79 MAPK14 (1.00) MAPK14KITMAPK9MAPK10KDR
SCHEMBL2948437 0.79 MAPK14 (0.70) MAPK14KITMAPK9MAPK10KDR
SCHEMBL1405970 0.78 MAPK14 (0.68) MAPK14KITMAPK9MAPK10KDR
SCHEMBL2945976 0.74 MAPK14 (0.60) MAPK14KITMAPK9MAPK10KDR
SCHEMBL2945803 0.73 MAPK14 (1.00) MAPK14KITMAPK9MAPK10KDR

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-8101612-B2 N-3-isoxazolyl-4-methyl-3-(1-((1-methylethyl)oxy)-6-phthalazinyl)benzamide; p38 kinase inhibitor; antiinflammatory, analgesic agent; rheumatoid arthritis, osteoporosis, leukemia, psoriasis, Crohn's disease, rhinitis, ulcerative colitis, dermatitis, asthma, Alzheimer's disease, type I and II diabetes AMGEN INC. (US) 2012-01-24 US claimed
EP-2077998-B1 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2011-03-09 EP disclosed