SCHEMBL4825973

SCHEMBL4825973

CCOC(=O)c1ccc2c(/N=C/C(O)(CC(C)(C)c3cc(Cl)ccc3OC)C(F)(F)F)cccc2n1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 14/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NR1H4 Q96RI1 1/20 0.38
NR3C2 P08235 9/20 0.37
PGR P06401 3/20 0.37
MRGPRX4 Q96LA9 1/20 0.37
IGF1R P08069 1/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL4825975 1.00 NR3C1 (0.40) NR3C1MEN1KMT2ANR1H4NR3C2
SCHEMBL4825978 1.00 NR3C1 (0.40) NR3C1MEN1KMT2ANR1H4NR3C2
SCHEMBL4823435 0.93 MRGPRX4 (0.43) NR3C1NR3C2PGRMRGPRX4IGF1R
SCHEMBL4823447 0.93 MRGPRX4 (0.43) NR3C1NR3C2PGRMRGPRX4IGF1R
SCHEMBL4823443 0.93 MRGPRX4 (0.43) NR3C1NR3C2PGRMRGPRX4IGF1R
SCHEMBL5203194 0.89 NR3C1 (0.39) NR3C1MEN1KMT2ANR3C2PGR
SCHEMBL4821113 0.87 MRGPRX4 (0.40) NR3C1MEN1KMT2ANR3C2PGR
SCHEMBL4821088 0.87 MRGPRX4 (0.40) NR3C1MEN1KMT2ANR3C2PGR
SCHEMBL4821100 0.87 MRGPRX4 (0.40) NR3C1MEN1KMT2ANR3C2PGR
SCHEMBL5203314 0.85 NR3C1 (0.40) NR3C1NR3C2PGRMRGPRX4IGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7329753-B2 Quinoline and isoquinoline derivatives, a process for their production and their use as inflammation inhibitors SCHERING AG (DE) 2008-02-12 US disclosed
US-20060229333-A1 Quinoline and isoquinoline derivatives, a process for their production and their use as inflammation inhibitors BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2006-10-12 US disclosed
US-20050165050-A1 Quinoline and isoquinoline derivatives, a process for their production and their use as inflammation inhibitors BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2005-07-28 US disclosed
US-6897224-B2 Quinoline and isoquinoline derivatives, a process for their production and their use as inflammation inhibitors SCHERING AG (DE) 2005-05-24 US disclosed
US-20040116694-A1 Quinoline and isoquinoline derivatives, a process for their production and their use as inflammation inhibitors SCHERING AG (DE) 2004-06-17 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-20060229333-A1 Quinoline and isoquinoline derivatives, a process for their production and their use as inflammation inhibitors NFKBIA, IL1B, IRF3 NR3C1 2380/4885MEN1 4490/4885KMT2A 3773/4885
US-20050165050-A1 Quinoline and isoquinoline derivatives, a process for their production and their use as inflammation inhibitors NFKBIA, IL1B, IRF3 NR3C1 2380/4885MEN1 4490/4885KMT2A 3773/4885

“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.