SCHEMBL3915630

SCHEMBL3915630

CS(=O)(=O)c1ccc(-c2ccc(NC(=O)C3=C(C(=O)O)CCC3)c(Cl)c2)cc1

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 17/20 0.71
NR4A2 P43354 2/20 0.47
JMJD7 P0C870 1/20 0.47
NR4A1 P22736 1/20 0.47
NR4A3 Q92570 1/20 0.47
NR1H4 Q96RI1 1/20 0.47
PTGS2 P35354 1/20 0.46
LMNA P02545 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
SCHEMBL3917879 0.86 DHODH (0.73) DHODHNR4A2JMJD7NR4A1NR4A3
SCHEMBL3918095 0.84 DHODH (0.63) DHODHNR4A2JMJD7NR4A1NR4A3
SCHEMBL3915232 0.83 DHODH (1.00) DHODHNR4A2JMJD7NR4A1NR4A3
SCHEMBL3925172 0.82 DHODH (0.70) DHODHNR4A2PTGS2
SCHEMBL3915691 0.81 DHODH (0.72) DHODHPTGS2
SCHEMBL4400150 0.81 DHODH (0.73) DHODHNR4A2JMJD7NR4A1NR4A3
SCHEMBL3914031 0.80 DHODH (0.78) DHODHNR4A2JMJD7NR4A1NR4A3
SCHEMBL20520371 0.78 DHODH (0.82) DHODHNR4A2JMJD7NR4A1NR4A3
SCHEMBL3915757 0.76 DHODH (0.72) DHODHNR4A2JMJD7NR4A1NR4A3
SCHEMBL3924656 0.76 DHODH (0.65) DHODHNR4A2JMJD7NR4A1NR4A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1392642-B1 NOVEL COMPOUNDS AS ANTI-INFLAMMATORY, IMMUNOMODULATORY AND ANTI-PROLIFERATORY AGENTS 4SC AG (DE) 2009-12-09 EP disclosed
EP-2093214-A1 Novel compounds as anti-inflammatory, immunomodulatory and anti-proliferatory agents 4SC AG (DE) 2009-08-26 EP disclosed
US-7423057-B2 Compounds as anti-inflammatory, immunomodulatory and anti-proliferatory agents 4SC AG (DE) 2008-09-09 US disclosed
US-7176241-B2 Compounds as anti-inflammatory, immunomodulatory and anti-proliferatory agents 4SC AG (DE) 2007-02-13 US disclosed
US-20060199856-A1 Novel compounds as anti-inflammatory, immunomodulatory and anti-proliferatory agents 4 SC AG (DE) 2006-09-07 US disclosed
US-20030203951-A1 Novel compounds as anti-inflammatory, immunomodulatory and anti-proliferatory agents 4SC AG (DE) 2003-10-30 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-20030203951-A1 Novel compounds as anti-inflammatory, immunomodulatory and anti-proliferatory agents DHODH, DLD, GCDH DHODH 1/4885NR4A2 800/4885JMJD7 1570/4885
US-20060199856-A1 Novel compounds as anti-inflammatory, immunomodulatory and anti-proliferatory agents DHODH, DLD, HADHA DHODH 1/4885NR4A2 587/4885JMJD7 1086/4885

“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.