SCHEMBL13653142

SCHEMBL13653142

OCCc1nc(-c2ccccc2)c(-c2ccccc2)o1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 12/20 0.69
RXRA P19793 10/20 0.69
RXRB P28702 9/20 0.69
RXRG P48443 6/20 0.69
NR4A1 P22736 3/20 0.69
NR4A3 Q92570 3/20 0.69
KDM4E B2RXH2 1/20 0.69
ABCC4 O15439 1/20 0.69
C5 P01031 1/20 0.69
LMNA P02545 1/20 0.69
CHRM2 P08172 1/20 0.69
CYP3A4 P08684 1/20 0.69
CHRM1 P11229 1/20 0.69
DRD2 P14416 1/20 0.69
HPGD P15428 1/20 0.69
TSHR P16473 1/20 0.69
TBXA2R P21731 1/20 0.69
PTGS1 P23219 1/20 0.69
HTR2A P28223 1/20 0.69
HTR2C P28335 1/20 0.69

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
SCHEMBL18063471 0.90 NR4A2 (0.71) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL14867495 0.89 NR4A2 (0.73) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL8929931 0.86 NR4A2 (0.68) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL8550570 0.85 NR4A2 (0.57) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL9024857 0.85 PTGS2 (0.64) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL8547030 0.85 NR4A2 (0.57) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL11719710 0.83 NR4A2 (0.65) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL7492453 0.83 NR4A2 (0.66) NR4A2RXRARXRBRXRGNR4A1
SCHEMBL13653143 0.83 NR4A2 (0.65) NR4A2RXRARXRBRXRGNR4A1
Oxaprozin SCHEMBL3286 0.82 RXRA (1.00) NR4A2RXRARXRBRXRGNR4A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090247488-A1 ANTI-INFLAMMATORY PHOSPHONATE COMPOUNDS CANNIZZARO CARINA 2009-10-01 US disclosed
US-20090247488-A1 ANTI-INFLAMMATORY PHOSPHONATE COMPOUNDS CANNIZZARO CARINA 2009-10-01 US disclosed
US-7432261-B2 Anti-inflammatory phosphonate compounds GILEAD SCIENCES, INC. (US) 2008-10-07 US disclosed
US-7432261-B2 Anti-inflammatory phosphonate compounds GILEAD SCIENCES, INC. (US) 2008-10-07 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-20090247488-A1 ANTI-INFLAMMATORY PHOSPHONATE COMPOUNDS PHOSPHO1, TNF, PTGES NR4A2 1050/4885RXRA 1906/4885RXRB 2036/4885

“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.