SCHEMBL6147274

SCHEMBL6147274

CCOC(=O)c1ccc(/C=C/C(Cc2ccc(C(F)(F)F)cc2)c2ccc3c(c2)C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RARA P10276 6/20 0.47
RARB P10826 6/20 0.47
RARG P13631 4/20 0.47
NOS3 P29474 2/20 0.39
NOS1 P29475 2/20 0.39
NOS2 P35228 2/20 0.39
MAOB P27338 2/20 0.39
CYP1A1 P04798 1/20 0.39
CYP1B1 Q16678 1/20 0.39
PPARG P37231 2/20 0.38
EPHX2 P34913 1/20 0.38
PTPN1 P18031 1/20 0.38
CYP26A1 O43174 2/20 0.37
CYP3A4 P08684 1/20 0.37
CYP26B1 Q9NR63 1/20 0.37
RXRA P19793 2/20 0.37
RXRB P28702 1/20 0.37
CETP P11597 1/20 0.36

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
SCHEMBL6147576 0.89 RARB (0.54) RARARARBRARGPPARGCYP26A1
SCHEMBL6147051 0.89 RARA (0.52) RARARARBRARGPPARGCYP26A1
SCHEMBL6143918 0.89 RARB (0.61) RARARARBRARGCYP26A1CYP3A4
SCHEMBL6143923 0.89 RARB (0.61) RARARARBRARGCYP26A1CYP3A4
SCHEMBL6144266 0.81 RARB (0.51) RARARARBRARGNOS3NOS1
SCHEMBL6147277 0.81 RARA (0.45) RARARARBRARGNOS3NOS1
SCHEMBL6147271 0.81 RARA (0.45) RARARARBRARGNOS3NOS1
SCHEMBL6147185 0.81 RARB (0.52) RARARARBRARGPPARGCYP26A1
SCHEMBL6147785 0.81 RARB (0.52) RARARARBRARGCYP26A1CYP3A4
SCHEMBL6149401 0.81 RARA (0.52) RARARARBRARGPPARGCYP26A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1280757-B1 NEW GAMMA SELECTIVE RETINOIDS HOFFMANN LA ROCHE (CH) 2005-08-17 EP disclosed
US-6603012-B2 RAR selective retinoid agonists HOFFMANN-LA ROCHE INC. 2003-08-05 US disclosed
US-20020026060-A1 RAR selective retinoid agonists F.HOFFMANN-LA ROCHE AG (CH) 2002-02-28 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-20020026060-A1 RAR selective retinoid agonists RARA, RARG, RARB RARA 1/4885RARB 3/4885RARG 2/4885

“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.