SCHEMBL7158656

SCHEMBL7158656

CC(C)C1CCC(C)(C)c2ccc(C(=O)Oc3ccc(C(=O)O)cc3)cc21

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRA P19793 11/20 0.48
RXRB P28702 8/20 0.48
RXRG P48443 6/20 0.48
RARB P10826 10/20 0.47
RARA P10276 8/20 0.47
RARG P13631 8/20 0.44
CYP26A1 O43174 3/20 0.44
CYP3A4 P08684 3/20 0.44
CYP26B1 Q9NR63 2/20 0.44
CRABP2 P29373 1/20 0.42

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
SCHEMBL6292641 0.89 RXRA (0.52) RXRARXRBRXRGRARBRARA
SCHEMBL6294271 0.87 RXRA (0.49) RXRARXRBRXRGRARBRARA
SCHEMBL6294155 0.83 RARA (0.49) RARBRARARARGCYP26A1CYP3A4
SCHEMBL6297298 0.81 RXRA (0.46) RXRARXRBRXRGRARBRARA
SCHEMBL6292968 0.80 RARB (0.62) RXRARXRBRXRGRARBRARA
SCHEMBL6292438 0.80 RXRA (0.40) RXRARXRBRXRGRARBRARA
SCHEMBL9165893 0.79 RXRA (0.69) RXRARXRBRXRGRARBRARA
SCHEMBL6294100 0.79 RXRA (0.47) RXRARXRBRXRGRARBRARA
SCHEMBL6292635 0.76 RARA (0.62) RARBRARARARGCYP3A4
SCHEMBL12620654 0.75 RARB (0.38) RXRARXRBRXRGRARBRARA

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-6555690-B2 4-((5,5-dimethyl-5,6,7,8-tetrahydro-8-hydroxynaphthalen-2 -yl)carbonyloxy)benzoic acid, benzyl ester for example; receptor subtype selectivity for side effect reduction ALLERGAN, INC. 2003-04-29 US disclosed
US-20020173631-A1 Alkyl or aryl substituted dihydronaphthalene derivatives having retinoid and/or retinoid antagonist-like biological activity ALLERGAN, INC. 2002-11-21 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-20020173631-A1 Alkyl or aryl substituted dihydronaphthalene derivatives having retinoid and/or retinoid antagonist-like biological activity RARB, RARA, RXRB RXRA 4/4885RXRB 3/4885RXRG 6/4885

“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.