SCHEMBL398172

SCHEMBL398172

Cc1ccc(C(=O)NC(C)C)cc1-c1ccc2c(O[C@H](C)C(F)(F)F)nncc2c1

nearest known ligand 0.79

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 14/20 0.79
KIT P10721 10/20 0.79
KDR P35968 8/20 0.79
MAPK9 P45984 6/20 0.79
LCK P06239 5/20 0.79
MAPK10 P53779 2/20 0.79
LYN P07948 1/20 0.79
ABL1 P00519 2/20 0.40
DDR2 Q16832 4/20 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
SCHEMBL398050 1.00 MAPK14 (0.79) MAPK14KITKDRMAPK9LCK
SCHEMBL397175 1.00 MAPK14 (0.79) MAPK14KITKDRMAPK9LCK
SCHEMBL397312 0.93 MAPK14 (0.79) MAPK14KITKDRMAPK9LCK
SCHEMBL397124 0.91 MAPK14 (0.77) MAPK14KITKDRMAPK9LCK
SCHEMBL398047 0.90 MAPK14 (0.76) MAPK14KITKDRMAPK9LCK
SCHEMBL1406009 0.90 MAPK14 (0.77) MAPK14KITKDRMAPK9LCK
SCHEMBL1406123 0.90 MAPK14 (0.77) MAPK14KITKDRMAPK9LCK
SCHEMBL395839 0.89 MAPK14 (0.75) MAPK14KITKDRMAPK9LCK
SCHEMBL395416 0.89 MAPK14 (0.75) MAPK14KITKDRMAPK9LCK
SCHEMBL396376 0.89 MAPK14 (0.73) MAPK14KITKDRMAPK9LCK

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 6 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 claimed
US-20080119468-A1 Phthalazine, aza-and diaza-phthalazine compounds and methods of use AMGEN INC. (US) 2008-05-22 US claimed
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 disclosed
EP-2077998-B1 PHTHALAZINE, AZA- AND DIAZA-PHTHALAZINE COMPOUNDS AND METHODS OF USE AMGEN INC (US) 2011-03-09 EP disclosed
US-20080119468-A1 Phthalazine, aza-and diaza-phthalazine compounds and methods of use AMGEN INC. (US) 2008-05-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080119468-A1 Phthalazine, aza-and diaza-phthalazine compounds and methods of use DAPK2, CDK2, DAPK1 MAPK14 293/4885KIT 1977/4885KDR 683/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.