SCHEMBL6147973

SCHEMBL6147973

CCCCCC(C=O)c1ccc2c(c1)C(C)(C)CCS2

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RARA P10276 8/20 0.39
RARB P10826 8/20 0.39
RARG P13631 8/20 0.39
RXRA P19793 3/20 0.39
CYP3A4 P08684 2/20 0.36
KMT2A Q03164 1/20 0.36
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
CYP26A1 O43174 1/20 0.34
SSTR5 P35346 1/20 0.33
HNF4A P41235 1/20 0.30

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
SCHEMBL6143648 0.83 RXRA (0.42) RARARARBRARGRXRACYP3A4
SCHEMBL6143651 0.83 RXRA (0.42) RARARARBRARGRXRACYP3A4
SCHEMBL6146841 0.82 RXRA (0.41) RARARARBRARGRXRACYP3A4
SCHEMBL6146847 0.82 RXRA (0.41) RARARARBRARGRXRACYP3A4
SCHEMBL6144478 0.81 RARA (0.43) RARARARBRARGRXRACYP3A4
SCHEMBL6146594 0.80 RARA (0.54) RARARARBRARGRXRACYP3A4
SCHEMBL6146583 0.80 RARA (0.54) RARARARBRARGRXRACYP3A4
SCHEMBL6146600 0.80 RARA (0.38) RARARARBRARGRXRACYP3A4
SCHEMBL6143563 0.79 RARA (0.42) RARARARBRARGRXRACYP3A4
SCHEMBL6146813 0.79 RXRA (0.43) RARARARBRARGRXRACYP3A4

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
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
EP-1280757-A2 NEW GAMMA SELECTIVE RETINOIDS F. HOFFMANN-LA ROCHE AG (CH) 2003-02-05 EP disclosed
US-20020026060-A1 RAR selective retinoid agonists F.HOFFMANN-LA ROCHE AG (CH) 2002-02-28 US disclosed
WO-2001083438-A2 NEW GAMMA SELECTIVE RETINOIDS F. HOFFMANN-LA ROCHE AG (CH) 2001-11-08 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 (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.