SCHEMBL6479495

SCHEMBL6479495

CC1(C)CCC(C)(C)c2cc(-c3cc(C=CC(=O)O)ccc3O)c(OCc3cccc(F)c3)cc21

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.59
AKR1C3 P42330 11/20 0.52
GSK3B P49841 1/20 0.46
BACE1 P56817 1/20 0.46
KDM4E B2RXH2 1/20 0.44
LMNA P02545 1/20 0.44
CA2 P00918 1/20 0.44
CA5A P35218 1/20 0.44
CA9 Q16790 1/20 0.44
AKR1C4 P17516 1/20 0.42
AKR1C1 Q04828 1/20 0.42
ESR1 P03372 1/20 0.42
ACHE P22303 1/20 0.42
AKR1C2 P52895 1/20 0.42
HCAR2 Q8TDS4 1/20 0.41

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
SCHEMBL6479493 1.00 RXRA (0.59) RXRAAKR1C3GSK3BBACE1KDM4E
SCHEMBL6472504 0.91 RXRA (0.61) RXRAAKR1C3GSK3BBACE1KDM4E
SCHEMBL6472506 0.91 RXRA (0.61) RXRAAKR1C3GSK3BBACE1KDM4E
SCHEMBL6472658 0.91 RXRA (0.66) RXRAAKR1C3GSK3BBACE1KDM4E
SCHEMBL6472662 0.91 RXRA (0.66) RXRAAKR1C3GSK3BBACE1KDM4E
SCHEMBL6473686 0.89 RXRA (0.58) RXRAAKR1C3GSK3BBACE1KDM4E
SCHEMBL6473692 0.89 RXRA (0.58) RXRAAKR1C3GSK3BBACE1KDM4E
SCHEMBL6472615 0.85 RXRA (0.61) RXRAAKR1C3GSK3BBACE1KDM4E
SCHEMBL6472436 0.85 RXRA (0.61) RXRAAKR1C3GSK3BBACE1KDM4E
SCHEMBL6472438 0.85 RXRA (0.61) RXRAAKR1C3GSK3BBACE1KDM4E

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 RXRA 174/4885AKR1C3 225/4885GSK3B 3233/4885

“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.