SCHEMBL6719685

SCHEMBL6719685

COCC1CN(CCC=C2CC=C(NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccc(C)cc3)c3ccccc32)CCO1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.46
MAPK13 O15264 5/20 0.46
MAPK12 P53778 4/20 0.46
MAPK11 Q15759 4/20 0.46
MAPK9 P45984 3/20 0.46
NTRK1 P04629 2/20 0.46
TNF P01375 2/20 0.46
ABL1 P00519 2/20 0.46
RAF1 P04049 2/20 0.46
LYN P07948 2/20 0.46
SRC P12931 2/20 0.46
DDR2 Q16832 2/20 0.46
CIT O14578 1/20 0.46
MUSK O15146 1/20 0.46
MAP3K7 O43318 1/20 0.46
RIPK2 O43353 1/20 0.46
STK10 O94804 1/20 0.46
MAP4K4 O95819 1/20 0.46
CHEK2 O96017 1/20 0.46
EGFR P00533 1/20 0.46

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
SCHEMBL20876989 0.77 TNF (0.77) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL6719679 0.77 MAPK14 (0.76) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL295875 0.77 TNF (0.77) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL6273681 0.75 TNF (0.69) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL296936 0.74 MAPK14 (0.57) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL7967169 0.73 MAPK14 (0.49) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL4689610 0.71 TNF (0.75) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL13652994 0.70 TNF (0.79) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL13234600 0.70 TNF (0.79) MAPK14MAPK13MAPK12MAPK11MAPK9
SCHEMBL13498271 0.69 TNF (0.77) MAPK14MAPK13MAPK12MAPK11MAPK9

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-6333325-B1 ADMINISTERING PYRAZOLE DERIVATIVE OF UREA OR THIOUREA FOR THERAPY OF CYTOKINE MEDIATED DISEASE SUCH AS ACTUATE AND CHRONIC PAIN, CONTACT DERMATITIS, ATHEROSCLEROSIS, GLOMERULONEPHRITIS, REPERFUSION INJURY, BONE RESORPTION BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. 2001-12-25 US claimed
US-20040152725-A1 Methods of treating cancer BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2004-08-05 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-20040152725-A1 Methods of treating cancer IL2, IL36G, IFNG MAPK14 3691/4885MAPK13 4084/4885MAPK12 3877/4885

“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.