SCHEMBL3525660

SCHEMBL3525660

Cc1ccc(C(=O)NC2CC2)cc1-c1ccc2c(N3CCOCC3)noc2c1

nearest known ligand 0.85

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 2/20 0.85
MAPK14 Q16539 16/20 0.70
KIT P10721 5/20 0.70
KDR P35968 5/20 0.70
LCK P06239 4/20 0.70
MAPK9 P45984 3/20 0.70
RIPK2 O43353 2/20 0.56
MAP2K1 Q02750 1/20 0.55
MAPK10 P53779 1/20 0.52
RAF1 P04049 1/20 0.50

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
SCHEMBL3524620 0.90 MAPK13 (0.83) MAPK13MAPK14KITKDRLCK
SCHEMBL3524612 0.85 MAPK14 (0.66) MAPK13MAPK14KITKDRLCK
SCHEMBL3521553 0.85 MAPK13 (0.75) MAPK13MAPK14KITKDRLCK
SCHEMBL3527377 0.84 MAPK14 (0.65) MAPK13MAPK14KITKDRLCK
SCHEMBL6171833 0.84 MAPK14 (0.65) MAPK13MAPK14KITKDRLCK
SCHEMBL3525957 0.83 MAPK14 (0.84) MAPK13MAPK14KITKDRLCK
SCHEMBL2945618 0.82 MAPK14 (1.00) MAPK13MAPK14KITKDRLCK
SCHEMBL3523996 0.82 MAPK14 (1.00) MAPK13MAPK14KITKDRLCK
SCHEMBL2956864 0.80 MAPK14 (0.95) MAPK13MAPK14KITKDRLCK
SCHEMBL3526077 0.79 MAPK14 (0.74) MAPK13MAPK14KITKDRLCK

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7642276-B2 Fused heteroaryl derivatives for use as P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2010-01-05 US claimed
EP-1531812-B1 FUSED HETEROARYL DERIVATIVES FOR USE AS P38 KINASE INHIBITORS IN THE TREATMENT OF I.A. RHEUMATOID ARTHRITIS SMITHKLINE BEECHAM CORP (US) 2007-06-27 EP claimed
US-20060122221-A1 Fused heteroaryl derivatives for use as p38 kinase inhibitors in the treatment of i.a. rheumatoid arthristis SMITHKLINE BEECHAM CORPORATION 2006-06-08 US claimed
US-7750026-B2 Fused heteroaryl derivatives and their use as p38 kinase inhibitors GLAXOSMITHKLINE LLC (US) 2010-07-06 US disclosed
US-7642276-B2 Fused heteroaryl derivatives for use as P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2010-01-05 US disclosed
US-7642276-B2 Fused heteroaryl derivatives for use as P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2010-01-05 US disclosed
US-7642276-B2 Fused heteroaryl derivatives for use as P38 kinase inhibitors SMITHKLINE BEECHAM CORPORATION (US) 2010-01-05 US disclosed
EP-1531812-B1 FUSED HETEROARYL DERIVATIVES FOR USE AS P38 KINASE INHIBITORS IN THE TREATMENT OF I.A. RHEUMATOID ARTHRITIS SMITHKLINE BEECHAM CORP (US) 2007-06-27 EP disclosed
US-20070054942-A1 Fused heteroaryl derivatives and their use as p38 kinase inhibitors GLAXOSMITHKLINE LLC 2007-03-08 US disclosed
US-20060122221-A1 Fused heteroaryl derivatives for use as p38 kinase inhibitors in the treatment of i.a. rheumatoid arthristis SMITHKLINE BEECHAM CORPORATION 2006-06-08 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 (2 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-20060122221-A1 Fused heteroaryl derivatives for use as p38 kinase inhibitors in the treatment of i.a. rheumatoid arthristis MAPK7, CNKSR1, MAPK1 MAPK13 19/4885MAPK14 11/4885KIT 3295/4885
US-20070054942-A1 Fused heteroaryl derivatives and their use as p38 kinase inhibitors MAPK1, MAPK7, MAPKAPK2 MAPK13 34/4885MAPK14 18/4885KIT 1999/4885

“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.