SCHEMBL8715669

SCHEMBL8715669

C[SiH](C)Oc1c([Bi](c2ccc3cc(C(C)(C)C)ccc3c2O[SiH](C)C)c2ccc3cc(C(C)(C)C)ccc3c2O[SiH](C)C)ccc2cc(C(C)(C)C)ccc12

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.37
KIF11 P52732 2/20 0.33
TDO2 P48775 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
SCHEMBL1680171 0.81 NR1I2 (0.38) NR1I2KIF11TDO2
SCHEMBL6063293 0.81 NR1I2 (0.38) NR1I2KIF11TDO2
SCHEMBL17962916 0.78 NR1I2 (0.36) NR1I2TDO2
SCHEMBL8718909 0.74 CA1 (0.38) KIF11
SCHEMBL8680470 0.74 KIF11 (0.41) NR1I2KIF11
SCHEMBL28898073 0.70 ALDH1A1 (0.46)
SCHEMBL4027510 0.69 NR1I2 (0.35) NR1I2KIF11
SCHEMBL7196050 0.66 NR1I2 (0.32) NR1I2KIF11
SCHEMBL1415048 0.66 LMNA (0.34) NR1I2
SCHEMBL1680164 0.65 NR1I2 (0.31) NR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0722448-A4 O-ARYL, O-ALKYL, O-ALKENYL AND O-ALKYNYL-MACROLIDES HAVING IMMUNOSUPPRESSIVE ACTIVITY MERCK & CO INC (US) 1998-04-29 EP disclosed
US-5693648-A TREATMENT OF AUTOIMMUNE DISEASES, INFECTIOUS DISEASES, PREVENTING REJECTION OF ORGAN TRANSPLANTS MERCK & CO., INC. (US) 1997-12-02 US disclosed
US-5565560-A TREATING AUTOIMMUNE DISEASES, PREVENTING TRANSPLANT REJECTION MERCK & CO., INC. (US) 1996-10-15 US disclosed
EP-0722448-A1 O-ARYL, O-ALKYL, O-ALKENYL AND O-ALKYNYL-MACROLIDES HAVING IMMUNOSUPPRESSIVE ACTIVITY MERCK & CO. INC. (US) 1996-07-24 EP disclosed
US-5532248-A O-aryl,O-alkyl, and O-alkenyl-macrolides having immunosuppressive activity MERCK CO., INC. (US) 1996-07-02 US disclosed
WO-1995009857-A1 O-ARYL, O-ALKYL, O-ALKENYL AND O-ALKYNYL-MACROLIDES HAVING IMMUNOSUPPRESSIVE ACTIVITY MERCK & CO., INC. (US) 1995-04-13 WO disclosed
US-5262533-A Autoimmune diseases or prevention of organ rejection or antiinflammatory agents MERCK & CO., INC. (US) 1993-11-16 US disclosed
US-5250678-A For autoimmune, infectious diseases, organ transplant rejection; skin diseases, antiinflammatory agents MERCK & CO., INC. (US) 1993-10-05 US disclosed
EP-0530888-A1 Fluoromacrolides having immunosuppressive activity MERCK & CO. INC. (US) 1993-03-10 EP disclosed
US-5189042-A Treating autoimmune diseases, preventing transplant rejection MERCK & CO. INC. (US) 1993-02-23 US disclosed
WO-1992020688-A1 AMINO O-ARYL, O-ALKYL, O-ALKENYL AND O-ALKYNYL MACROLIDES MERCK & CO., INC. (US) 1992-11-26 WO disclosed
EP-0515071-A2 O-aryl, O-alkyl, O-alkenyl and O-alkynylmacrolides having immunosuppressive activity MERCK & CO. INC. (US) 1992-11-25 EP disclosed