SCHEMBL6472385

SCHEMBL6472385

CC(C)(C)c1cc(B(O)O)c(OCc2ccccc2)c(C(C)(C)C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 1/20 0.49
RXRA P19793 2/20 0.41
RXRB P28702 2/20 0.41
RXRG P48443 1/20 0.41
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
FEN1 P39748 1/20 0.39
NR4A2 P43354 2/20 0.39
NR4A1 P22736 1/20 0.39
NR4A3 Q92570 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 1/20 0.39
ENPP2 Q13822 1/20 0.39
MAOB P27338 1/20 0.38
ALOX5AP P20292 1/20 0.38
GLRA1 P23415 1/20 0.37
MRGPRX4 Q96LA9 2/20 0.37

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
SCHEMBL8157254 0.84 LMNA (0.50) RXRARXRBRXRGLMNAHPGD
SCHEMBL29201865 0.82 RXRA (0.46) LIPERXRARXRBRXRGLMNA
SCHEMBL6473455 0.81 THRB (0.46) RXRARXRBRXRGLMNAHPGD
SCHEMBL6032596 0.80 FEN1 (0.39) RXRARXRBRXRGLMNAHPGD
SCHEMBL12774485 0.79 FEN1 (0.39) RXRARXRBRXRGLMNAHPGD
SCHEMBL4863445 0.79 RXRA (0.44) RXRARXRBRXRGCYP1A2CYP3A4
SCHEMBL15674928 0.78 LIPE (0.62) LIPERXRARXRBRXRGLMNA
SCHEMBL29951292 0.78 LIPE (0.62) LIPERXRARXRBRXRGLMNA
SCHEMBL6032599 0.78 FEN1 (0.38) RXRARXRBRXRGLMNAHPGD
SCHEMBL14112773 0.77 MAPT (0.46) LIPELMNAHPGDNR4A2NR4A1

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
US-6924388-B2 Bicyclic aromatic compounds and pharmaceutical/cosmetic compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-08-02 US disclosed
US-20040092594-A1 Bicyclic aromatic compounds and pharmaceutical/cosmetic compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-05-13 US disclosed
US-6632963-B1 Are useful for the treatment of a wide variety of disease states, whether human or veterinary, for example dermatological, rheumatic, respiratory, cardiovascular and ophthalmological disorders, as well as for the treatment of GALDERMA RESEARCH & DEVELOPMENT S.N.C. (FR) 2003-10-14 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-20040092594-A1 Bicyclic aromatic compounds and pharmaceutical/cosmetic compositions comprised thereof AHR, TYR, MC1R LIPE 460/4885RXRA 174/4885RXRB 259/4885

“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.