SCHEMBL6455060

SCHEMBL6455060

CCc1c(OC(=O)c2ccc3c(c2)C(COC)CCC3(C)C)ccc(C(=O)O)c1[Si](C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.33
RARG P13631 10/20 0.33
RXRA P19793 9/20 0.32
HNF4A P41235 2/20 0.32
RARA P10276 6/20 0.31
RARB P10826 4/20 0.31
RXRG P48443 2/20 0.31
HIF1A Q16665 1/20 0.31
RXRB P28702 1/20 0.31

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
SCHEMBL8560366 0.81 KDM4C (0.39) KDM4CRARGRXRAHNF4ARARA
SCHEMBL7688528 0.80 RARA (0.34) KDM4CRARGRXRARARARARB
SCHEMBL6297298 0.77 RXRA (0.46) RARGRXRARARARARBRXRG
SCHEMBL8558259 0.73 F2 (0.38) KDM4CRARGRXRARARBRXRG
SCHEMBL8560364 0.73 CYP3A4 (0.38) KDM4CRARGRXRARARARARB
SCHEMBL6708918 0.73 RARA (0.57) RARGRARARARB
SCHEMBL6596539 0.71 RARA (0.44) RARGRARARARBHIF1A
SCHEMBL6292634 0.70 RXRA (0.45) RARGRXRAHNF4ARARARARB
SCHEMBL6293050 0.69 RARA (0.60) RARGRXRARARARARBRXRG
SCHEMBL8671861 0.69 RARB (0.58) RARGRARARARB

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 KDM4C 4308/4885RARG 5/4885RXRA 4/4885

“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.