SCHEMBL4833285

SCHEMBL4833285

COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(NC(=O)c3cc(F)cc(N4CCOCC4)c3)ccc2C)c1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 0.60
CYP3A4 P08684 1/20 0.49
CYP2C9 P11712 1/20 0.49
SMO Q99835 1/20 0.49
RAF1 P04049 1/20 0.49
BRAF P15056 1/20 0.49

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
SCHEMBL7825175 0.91 MAPK14 (0.48) MAPK14CYP3A4CYP2C9
SCHEMBL4831657 0.89 MAPK14 (0.63) MAPK14CYP3A4CYP2C9SMORAF1
SCHEMBL4829487 0.83 RAF1 (0.60) MAPK14RAF1BRAF
SCHEMBL4829475 0.82 MAPK14 (0.48) MAPK14RAF1BRAF
SCHEMBL4831934 0.80 CSF1R (0.66) MAPK14RAF1BRAF
SCHEMBL7825479 0.80 MAPK14 (0.51) MAPK14CYP3A4CYP2C9
SCHEMBL4824273 0.79 BRAF (0.65) MAPK14RAF1BRAF
SCHEMBL4831597 0.78 RAC1 (0.61) MAPK14RAF1BRAF
SCHEMBL4409060 0.74 MAPK14 (0.54) MAPK14RAF1BRAF
SCHEMBL5897317 0.74 MAPK14 (0.66) MAPK14CYP3A4CYP2C9SMORAF1

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
US-7442704-B2 Amide derivatives ASTRAZENECA AB (SE) 2008-10-28 US disclosed
US-7332483-B2 3-(5-benzamido-2-chlorophenyl)-7-methoxy-3,4-dihydroquinazolin-4-one;cytokines (tumor necrosis factor and interleukins) inhibitor; antiinflammatory agent, rheumatoid arthritis, osteoarthritis, psoriasis, chronic obstructive pulmonary disease ASTRAZENECA AB (SE) 2008-02-19 US disclosed
US-20060281734-A1 Amide derivatives BROWN DEARG S 2006-12-14 US disclosed
US-7008945-B1 Amide derivatives ASTRAZENECA AB (SE) 2006-03-07 US disclosed
US-20050245551-A1 Amide derivatives ASTRAZENECA AB 2005-11-03 US disclosed
EP-1163237-A1 AMIDE DERIVATIVES AstraZeneca AB (SE) 2001-12-19 EP disclosed
WO-2000055153-A1 AMIDE DERIVATIVES ASTRAZENECA AB (SE) 2000-09-21 WO 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-20050245551-A1 Amide derivatives IL6, IL6ST, IL1B MAPK14 2834/4885CYP3A4 89/4885CYP2C9 85/4885
US-20060281734-A1 Amide derivatives IL6, IL6ST, IL1B MAPK14 2834/4885CYP3A4 89/4885CYP2C9 85/4885

“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.