SCHEMBL5623931

SCHEMBL5623931

COc1ccc(OC(F)(F)F)cc1NC(=O)Nc1ccc(Oc2cc(C)nc(CN3CCOCC3)n2)c2ccccc12

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 9/20 0.52
MAPK12 P53778 3/20 0.52
MAPK13 O15264 1/20 0.52
MAPK11 Q15759 1/20 0.52
KDR P35968 3/20 0.49
GSK3A P49840 9/20 0.44
SRC P12931 11/20 0.43
SYK P43405 11/20 0.43
HSP90AA1 P07900 1/20 0.42

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
SCHEMBL5622724 0.94 MAPK14 (0.43) MAPK14MAPK12MAPK13MAPK11KDR
SCHEMBL13941144 0.92 MAPK14 (0.54) MAPK14MAPK12MAPK13MAPK11KDR
SCHEMBL5622932 0.92 MAPK14 (0.44) MAPK14MAPK12MAPK13MAPK11KDR
SCHEMBL5622491 0.90 MAPK14 (0.55) MAPK14MAPK12MAPK13MAPK11KDR
SCHEMBL5622991 0.88 MAPK14 (0.52) MAPK14MAPK12MAPK13MAPK11KDR
SCHEMBL5645752 0.88 MAPK14 (0.54) MAPK14MAPK12MAPK13MAPK11GSK3A
SCHEMBL5623634 0.86 MAPK14 (0.52) MAPK14MAPK12MAPK13MAPK11GSK3A
SCHEMBL5623499 0.84 HSP90AA1 (0.46) MAPK14MAPK12MAPK13MAPK11KDR
SCHEMBL8271233 0.83 MAPK14 (0.54) MAPK14MAPK12MAPK13MAPK11KDR
SCHEMBL5622747 0.83 MAPK14 (0.56) MAPK14MAPK12MAPK13MAPK11KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1549621-A1 FLUORINATED PHENYL-NAPHTHALENYL-UREA COMPOUNDS AS INHIBITORS OF CYTOKINES INVOLVED IN INFLAMMATORY PROCESSES BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2005-07-06 EP claimed
WO-2004014870-A1 FLUORINATED PHENYL-NAPHTHALENYL-UREA COMPOUNDS AS INHIBITORS OF CYTOKINES INVOLVED IN INFLAMMATORY PROCESSES BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2004-02-19 WO claimed
US-7279475-B2 Fluorinated di-aryl urea compounds BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2007-10-09 US disclosed
US-7279475-B2 Fluorinated di-aryl urea compounds BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2007-10-09 US disclosed
US-7279475-B2 Fluorinated di-aryl urea compounds BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2007-10-09 US disclosed
US-6872726-B2 Fluorinated di-aryl urea compounds BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2005-03-29 US disclosed
US-20050032797-A1 Fluorinated di-aryl urea compounds BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-02-10 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-20050032797-A1 Fluorinated di-aryl urea compounds IL1B, MPO, IL1A MAPK14 1915/4885MAPK12 2202/4885MAPK13 1694/4885

“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.