SCHEMBL6260916

SCHEMBL6260916

Cc1cc2c(cc1C(=Cc1ccc(CO)s1)[Si](C)(C)C)C(C)(C)CCC2(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 20/20 0.49
▸ RXRG P48443 14/20 0.49
▸ RXRB P28702 13/20 0.49
▸ RARB P10826 9/20 0.49
▸ RARG P13631 8/20 0.49
▸ RARA P10276 5/20 0.41
▸ MEN1 O00255 1/20 0.38
▸ CYP26A1 O43174 1/20 0.38
▸ ABCB11 O95342 1/20 0.38
▸ ESR1 P03372 1/20 0.38
▸ PGR P06401 1/20 0.38
▸ HTR1A P08908 1/20 0.38
▸ ADRA2A P08913 1/20 0.38
▸ ADORA3 P0DMS8 1/20 0.38
▸ CHRM1 P11229 1/20 0.38
▸ DRD1 P21728 1/20 0.38
▸ TBXA2R P21731 1/20 0.38
▸ SLC6A2 P23975 1/20 0.38
▸ ADRA1A P35348 1/20 0.38
▸ OPRM1 P35372 1/20 0.38

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
SCHEMBL6260911 1.00 RXRA (0.49) RXRARXRGRXRBRARBRARG
SCHEMBL6259442 0.85 RXRA (0.48) RXRARXRGRXRBRARBRARG
SCHEMBL6259440 0.85 RXRA (0.48) RXRARXRGRXRBRARBRARG
SCHEMBL6263315 0.82 RXRA (0.74) RXRARXRGRXRBRARBRARG
SCHEMBL6263321 0.82 RXRA (0.74) RXRARXRGRXRBRARBRARG
SCHEMBL6427528 0.80 RXRA (0.56) RXRARXRGRXRBRARBRARG
SCHEMBL4586461 0.79 RXRA (0.49) RXRARXRGRXRBRARBRARG
SCHEMBL4586465 0.79 RXRA (0.49) RXRARXRGRXRBRARBRARG
SCHEMBL6427532 0.75 RXRA (0.48) RXRARXRGRXRBRARBRARG
SCHEMBL6260306 0.71 RXRA (0.72) RXRARXRGRXRBRARBRARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1185277-B1 Use of FXR synthetic ligands for the treatment of diseseas linked to cholesterol imbalance and colon cancer ALLERGAN INC (US) 2005-10-26 — — EP disclosed
US-6906057-B1 Methods for modulating FXR receptor activity ALLERGAN, INC. (US) 2005-06-14 — — US disclosed
EP-1185539-B1 ORGANOSILYL COMPOUNDS HAVING NUCLEAR HORMONE RECEPTOR MODULATING ACTIVITY ALLERGAN INC (US) 2004-12-01 — — EP disclosed
US-6452032-B1 ANTAGONISTS, AGONISTS, OR INVERSE AGONISTS PARTICULARLY FOR RETINOID AND FARNESOID RECEPTORS; REGULATORS OF CELL PROLIFERATION AND DIFFERENTIATION AND OF LIPID METABOLISM; DERMATOSES SUCH AS ACNE, PSORIASIS, ICTHYOSIS AND ECZEMA ALLERGAN SALES, LLC 2002-09-17 — — US disclosed
EP-1185277-A1 METHODS FOR MODULATING FXR RECEPTOR ACTIVITY Allergan Sales, Inc. (US) 2002-03-13 — — EP disclosed
EP-1185539-A1 ORGANOSILYL COMPOUNDS HAVING NUCLEAR HORMONE RECEPTOR MODULATING ACTIVITY Allergan Sales, Inc. (US) 2002-03-13 — — EP disclosed
WO-2000076523-A1 METHODS FOR MODULATING FXR RECEPTOR ACTIVITY ALLERGAN SALES, INC. (US) 2000-12-21 — — WO disclosed
WO-2000077011-A1 ORGANOSILYL COMPOUNDS HAVING NUCLEAR HORMONE RECEPTOR MODULATING ACTIVITY ALLERGAN SALES, INC. (US) 2000-12-21 — — WO disclosed
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