SCHEMBL5400573

SCHEMBL5400573

CC(CCOc1ccc(C(=O)O)cc1)Oc1ccc(C(=O)O)cc1

nearest known ligand 0.73

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.73
RARB P10826 5/20 0.60
KMT2A Q03164 1/20 0.59
PKM P14618 1/20 0.57
TSHR P16473 2/20 0.55
TP53 P04637 1/20 0.55
PLA2G4B P0C869 3/20 0.54
USP2 O75604 1/20 0.53
ALOX15 P16050 1/20 0.53
HSD17B10 Q99714 1/20 0.53
HTT P42858 1/20 0.51
RXRA P19793 1/20 0.50
RXRB P28702 1/20 0.50
ALDH1A1 P00352 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
NR1H4 Q96RI1 1/20 0.49
SRD5A2 P31213 1/20 0.49

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
SCHEMBL8432243 1.00 MAPK1 (0.73) MAPK1RARBKMT2APKMTSHR
SCHEMBL7613153 0.91 RARB (0.69) MAPK1RARBKMT2APKMTSHR
SCHEMBL20528135 0.89 RARB (0.68) MAPK1RARBKMT2APKMTSHR
SCHEMBL9319143 0.88 KMT2A (0.69) MAPK1RARBKMT2APKMTSHR
SCHEMBL9487296 0.88 MAPK1 (0.58) MAPK1RARBKMT2APKMTSHR
SCHEMBL13556990 0.87 MAPK1 (0.73) MAPK1RARBKMT2APKMTSHR
SCHEMBL8080304 0.85 MAPK1 (0.57) MAPK1RARBKMT2ATSHRTP53
SCHEMBL6538723 0.85 MAPK1 (1.00) MAPK1RARBKMT2APKMTSHR
SCHEMBL14539465 0.84 MAPK1 (0.69) MAPK1RARBPKMTSHRTP53
SCHEMBL7995208 0.83 KMT2A (0.62) MAPK1RARBKMT2ATSHRTP53

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-7312345-B2 Process for the preparation of dronedarone ISP INVESTMENTS INC. (US) 2007-12-25 US disclosed
US-20050049302-A1 Process for the preparation of dronedarone ISP INVESTMENTS LLC 2005-03-03 US disclosed
EP-0758013-B1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL CO LTD (JP) 2000-10-11 EP disclosed
US-5855971-A Liquid crystalline optical film, compensating film for liquid crystal display comprising the liquid crystalline optical film, and liquid crystal display having the compensating film NIPPON OIL COMPANY, LIMITED (JP) 1999-01-05 US disclosed
EP-0758013-A1 Liquid crystalline optical film, compensating film for liquid crystal display and liquid crystal display NIPPON OIL COMPANY, LIMITED (JP) 1997-02-12 EP 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-20050049302-A1 Process for the preparation of dronedarone CACNA1C, CACNA1A, KCNH1 MAPK1 1535/4885RARB 3280/4885KMT2A 876/4885

“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.