SCHEMBL12467122

SCHEMBL12467122

CC(C)(c1ccc(CC(=O)O)cc1)P(=O)(O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 7/20 0.53
EPHX2 P34913 1/20 0.53
RXRA P19793 2/20 0.50
RXRB P28702 2/20 0.50
RXRG P48443 2/20 0.50
ALDH1A1 P00352 2/20 0.49
HPGD P15428 1/20 0.49
HSD17B10 Q99714 1/20 0.49
CA2 P00918 1/20 0.47
CAMK2A Q9UQM7 1/20 0.47
AKR1B1 P15121 1/20 0.45
FFAR1 O14842 1/20 0.44
ABCC4 O15439 1/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
TSHR P16473 1/20 0.44
PTGS1 P23219 1/20 0.44
HTT P42858 1/20 0.44
PTPN1 P18031 2/20 0.43
MITF O75030 1/20 0.43

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
SCHEMBL840854 0.79 NR1H4 (0.70) NR1H4EPHX2RXRARXRBRXRG
SCHEMBL27940962 0.79 RXRA (0.58) NR1H4EPHX2RXRARXRBRXRG
SCHEMBL3385203 0.79 PTPN1 (0.66) PTPN1PTPN2PTPN6PTPN11
SCHEMBL1061936 0.77 RXRA (0.56) NR1H4EPHX2RXRARXRBRXRG
Methane SCHEMBL17237476 0.77 NR1H4 (0.68) NR1H4EPHX2RXRARXRBRXRG
Hydrochloric Acid SCHEMBL2528372 0.77 NR1H4 (0.68) NR1H4EPHX2RXRARXRBRXRG
SCHEMBL11520885 0.76 RXRA (0.54) NR1H4EPHX2RXRARXRBRXRG
SCHEMBL9785033 0.76 RXRA (0.54) NR1H4EPHX2RXRARXRBRXRG
SCHEMBL21133929 0.76 RXRA (0.54) NR1H4EPHX2RXRARXRBRXRG
SCHEMBL7182175 0.76 RXRA (0.54) NR1H4EPHX2RXRARXRBRXRG

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-10159750-B2 Immunogenic compositions and reagents for preparing PURDUE RESEARCH FOUNDATION (US) 2018-12-25 US disclosed
US-20180289820-A1 IMMUNOGENIC COMPOSITIONS AND REAGENTS FOR PREPARING PURDUE RESEARCH FOUNDATION (US) 2018-10-11 US disclosed
US-10010616-B2 Immunogenic compositions and reagents for preparing PURDUE RESEARCH FOUNDATION (US) 2018-07-03 US disclosed
US-20150023987-A1 IMMUNOGENIC COMPOSITIONS AND REAGENTS FOR PREPARING PURDUE RESEARCH FOUNDATION (US) 2015-01-22 US disclosed
WO-2012103444-A2 IMMUNOGENIC COMPOSITIONS AND REAGENTS FOR PREPARING PURDUE RESEARCH FOUNDATION (US) 2012-08-02 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 (4 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-20150023987-A1 IMMUNOGENIC COMPOSITIONS AND REAGENTS FOR PREPARING FCGRT, HLA-DRB1, CD47 NR1H4 3497/4885EPHX2 378/4885RXRA 3687/4885
US-20180289820-A1 IMMUNOGENIC COMPOSITIONS AND REAGENTS FOR PREPARING FCGRT, HLA-DRB1, CD47 NR1H4 3497/4885EPHX2 378/4885RXRA 3687/4885
US-10159750-B2 Immunogenic compositions and reagents for preparing FCGRT, HLA-DRB1, CD47 NR1H4 3497/4885EPHX2 378/4885RXRA 3687/4885
US-10010616-B2 Immunogenic compositions and reagents for preparing FCGRT, HLA-DRB1, CD47 NR1H4 3497/4885EPHX2 378/4885RXRA 3687/4885

“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.