SCHEMBL6294289

SCHEMBL6294289

CCOC(=O)CC1=CCC(C)(C)c2ccc(N=Nc3ccc(C(=O)O)cc3)cc21

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
RARA P10276 19/20 0.46
RARB P10826 19/20 0.46
RARG P13631 18/20 0.46
RXRA P19793 1/20 0.45
NR2E1 Q9Y466 1/20 0.45

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
SCHEMBL6294287 1.00 RARA (0.46) RARARARBRARGRXRANR2E1
SCHEMBL6292933 0.92 MAPT (0.44) RARARARBRARGRXRANR2E1
SCHEMBL6292931 0.92 MAPT (0.44) RARARARBRARGRXRANR2E1
SCHEMBL6297415 0.85 RARA (0.64) RARARARBRARGRXRANR2E1
SCHEMBL6297414 0.85 RARA (0.64) RARARARBRARGRXRANR2E1
SCHEMBL7637362 0.78 RARA (0.54) RARARARBRARG
SCHEMBL6235710 0.76 RARB (0.74) RARARARBRARGRXRANR2E1
SCHEMBL6235716 0.76 RARB (0.74) RARARARBRARGRXRANR2E1
SCHEMBL6292733 0.76 RARA (0.47) RARARARBRARGRXRANR2E1
SCHEMBL21538692 0.76 RARA (0.39) RARARARBRARGRXRANR2E1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6855832-B2 O- or S-substituted tetrahydronaphthalene derivatives having retinoid and/or retinoid antagonist-like biological activity ALLERGAN, INC. (US) 2005-02-15 US disclosed
US-20030078440-A1 O- or S-substituted tetrahydronaphthalene derivatives having retinoid and/or retinoid antagonist-like biological activity ALLERGAN, INC. 2003-04-24 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-20030078440-A1 O- or S-substituted tetrahydronaphthalene derivatives having retinoid and/or retinoid antagonist-like biological activity RARB, RARA, RXRB RARA 2/4885RARB 1/4885RARG 5/4885

“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.