SCHEMBL4212932

SCHEMBL4212932

CCOc1cccc(-c2ccc(CC(=O)O)cc2)c1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RXRA P19793 3/20 0.69
RXRB P28702 3/20 0.69
SLC13A5 Q86YT5 2/20 0.62
RXRG P48443 2/20 0.62
FFAR1 O14842 3/20 0.57
ABCC4 O15439 1/20 0.57
LMNA P02545 1/20 0.57
GAA P10253 1/20 0.57
TSHR P16473 1/20 0.57
PTGS1 P23219 1/20 0.57
HTT P42858 1/20 0.57
DHODH Q02127 1/20 0.52
PPARD Q03181 2/20 0.51
ICMT O60725 2/20 0.50
PTGER2 P43116 1/20 0.48
CTSA P10619 1/20 0.48
PTPN1 P18031 1/20 0.48
PTPN6 P29350 1/20 0.48
PTPN11 Q06124 1/20 0.48

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
SCHEMBL4214472 0.90 RXRA (0.62) RXRARXRBSLC13A5RXRGFFAR1
SCHEMBL4433415 0.85 RXRA (0.58) RXRARXRBSLC13A5RXRGFFAR1
SCHEMBL4206771 0.85 SLC13A5 (0.61) RXRARXRBSLC13A5RXRGFFAR1
SCHEMBL29936241 0.85 SLC13A5 (0.61) RXRARXRBSLC13A5RXRGFFAR1
SCHEMBL469914 0.84 RXRA (0.63) RXRARXRBRXRGFFAR1ABCC4
SCHEMBL5128966 0.83 FFAR1 (0.56) RXRARXRBSLC13A5RXRGFFAR1
SCHEMBL2458898 0.83 PLA2G4B (0.59) RXRARXRBLMNAPPARD
SCHEMBL4758879 0.82 RXRA (1.00) RXRARXRBSLC13A5RXRGFFAR1
SCHEMBL18314425 0.82 RXRA (1.00) RXRARXRBSLC13A5RXRGFFAR1
SCHEMBL4759655 0.81 RXRA (0.63) RXRARXRBSLC13A5FFAR1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090155903-A1 PHARMACEUTICAL COMPOSITION AND METHOD MYRIAD GENETICS, INCORPORATED (US) 2009-06-18 US disclosed
US-20090155903-A1 PHARMACEUTICAL COMPOSITION AND METHOD MYRIAD GENETICS, INCORPORATED (US) 2009-06-18 US disclosed
US-20090155903-A1 PHARMACEUTICAL COMPOSITION AND METHOD MYRIAD GENETICS, INCORPORATED (US) 2009-06-18 US disclosed
EP-1456180-B1 3-(2,4)DIHYDROXYPHENYL-4-PHENYLPYRAZOLES AND THEIR MEDICAL USE VERNALIS CAMBRIDGE LTD (GB) 2007-10-03 EP disclosed
EP-1456180-B1 3-(2,4)DIHYDROXYPHENYL-4-PHENYLPYRAZOLES AND THEIR MEDICAL USE VERNALIS CAMBRIDGE LTD (GB) 2007-10-03 EP disclosed
US-7247734-B2 3,4-diarylpyrazoles and their use in the therapy of cancer VERNALIS (CAMBRIDGE) LIMITED (GB) 2007-07-24 US disclosed
US-7247734-B2 3,4-diarylpyrazoles and their use in the therapy of cancer VERNALIS (CAMBRIDGE) LIMITED (GB) 2007-07-24 US disclosed
US-20050222230-A1 3,4-diarylpyrazoles and their use in the therapy of cancer VERNALIS (CAMBRIDGE) LIMITED (GB) 2005-10-06 US disclosed
EP-1456180-A1 3,4-DIARYLPYRAZOLES AND THEIR USE IN THE THERAPY OF CANCER Vernalis (Oxford) Ltd (GB) 2004-09-15 EP disclosed
WO-2003055860-A1 3,4-DIARYLPYRAZOLES AND THEIR USE IN THE THERAPY OF CANCER VERNALIS (CAMBRIDGE) LIMITED (GB) 2003-07-10 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-20090155903-A1 PHARMACEUTICAL COMPOSITION AND METHOD APP, PSEN2, PSEN1 RXRA 3288/4885RXRB 3134/4885SLC13A5 2507/4885
US-20050222230-A1 3,4-diarylpyrazoles and their use in the therapy of cancer HSP90AB1, HSP90AA1, HSP90AB2P RXRA 3476/4885RXRB 3164/4885SLC13A5 3258/4885

“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.