SCHEMBL6033247

SCHEMBL6033247

CC1(C)CCC(C)(C)c2c(OCc3ccccc3)cc([Se]c3ccc(C(=O)O)cn3)cc21

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GCK P35557 4/20 0.42
MAP4K4 O95819 1/20 0.40
RXRA P19793 11/20 0.40
RXRB P28702 5/20 0.39
RXRG P48443 5/20 0.39
RARA P10276 1/20 0.39
RARB P10826 1/20 0.39
RARG P13631 1/20 0.39
PPARG P37231 1/20 0.39
CYP26A1 O43174 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP26B1 Q9NR63 1/20 0.39
MRGPRX4 Q96LA9 2/20 0.39
HNF4A P41235 1/20 0.39

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
SCHEMBL6033014 0.87 RARG (0.45) RXRARXRBRXRGRARARARB
SCHEMBL6033002 0.87 RXRA (0.44) RXRARXRBRXRGRARARARB
SCHEMBL6033032 0.83 RARG (0.56) RXRARXRBRXRGRARARARB
SCHEMBL6032956 0.83 RXRA (0.46) GCKMAP4K4RXRARXRBRXRG
SCHEMBL6032919 0.83 MRGPRX4 (0.48) RXRAMRGPRX4
SCHEMBL6033029 0.83 RXRA (0.40) RXRARXRBRXRGRARARARB
SCHEMBL6033030 0.80 RXRA (0.39) RXRARXRBRXRGRARARARB
SCHEMBL6033347 0.77 RXRA (0.56) RXRARXRBRXRGRARARARB
SCHEMBL6032912 0.76 FAAH (0.41) GCKMAP4K4RXRARXRBRXRG
SCHEMBL6032620 0.76 L3MBTL1 (0.41) MRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060014803-A1 Diarylselenide compounds and their use in human or veterinary medicine and in cosmetics GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2006-01-19 US claimed
EP-1086080-B1 DIARYLSELENIDE COMPOUNDS AND THEIR USE IN HUMAN OR VETERINARY MEDICINE AND IN COSMETICS GALDERMA RES & DEV (FR) 2004-08-25 EP claimed
US-6992094-B1 Diarylselenide compounds and their use in human or veterinary medicine and in cosmetics GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2006-01-31 US disclosed
US-20060014803-A1 Diarylselenide compounds and their use in human or veterinary medicine and in cosmetics GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2006-01-19 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-20060014803-A1 Diarylselenide compounds and their use in human or veterinary medicine and in cosmetics TYR, DERL1, GPX1 GCK 3886/4885MAP4K4 3188/4885RXRA 1865/4885

“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.