SCHEMBL3743994

SCHEMBL3743994

C[Si](C)(Br)C(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 5/20 0.39
MAPK1 P28482 2/20 0.39
ALDH1A1 P00352 3/20 0.38
TSHR P16473 2/20 0.38
TAAR1 Q96RJ0 1/20 0.36
ALOX15 P16050 1/20 0.36
ESR1 P03372 2/20 0.34
ESR2 Q92731 2/20 0.34
CYP3A4 P08684 2/20 0.34
KMT2A Q03164 2/20 0.34
MAPT P10636 1/20 0.33
CYP19A1 P11511 1/20 0.32

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
SCHEMBL10332647 0.74 KCNN4 (0.43) KCNN4MAPK1ALDH1A1TSHRTAAR1
SCHEMBL6602963 0.74 ALDH1A1 (0.39) KCNN4MAPK1ALDH1A1TSHRTAAR1
SCHEMBL6322919 0.74 TSHR (0.43) KCNN4MAPK1ALDH1A1TSHRTAAR1
SCHEMBL6602971 0.74 ALDH1A1 (0.41) KCNN4MAPK1ALDH1A1TSHRTAAR1
SCHEMBL6324964 0.74 TSHR (0.43) KCNN4MAPK1ALDH1A1TSHRTAAR1
SCHEMBL6860477 0.74 ALDH1A1 (0.43) KCNN4MAPK1ALDH1A1TSHRTAAR1
SCHEMBL10332646 0.74 KCNN4 (0.39) KCNN4MAPK1ALDH1A1TSHRTAAR1
SCHEMBL22730200 0.72 MAPK1 (0.42) KCNN4MAPK1ALDH1A1TSHRTAAR1
SCHEMBL7754101 0.72 MAPK1 (0.42) KCNN4MAPK1ALDH1A1TSHRTAAR1
SCHEMBL6323711 0.70 MAPK1 (0.41) KCNN4MAPK1ALDH1A1TSHRTAAR1

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0419018-B1 Silylated lithographic printing plates AGFA GEVAERT NV (BE) 1998-10-28 EP claimed
EP-0419018-A2 Improvements in or relating to lithographic printing plates Du Pont (UK) Limited (GB) 1991-03-27 EP claimed
US-7830010-B2 Surface treatment for selective metal cap applications INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2010-11-09 US disclosed
US-20090250815-A1 SURFACE TREATMENT FOR SELECTIVE METAL CAP APPLICATIONS INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2009-10-08 US disclosed
US-7572303-B2 A symmetrical dialkyl carbonate, a metal, borong, silicon, or group 7 compound, a hydrogen or hydrocarbon-based fuel, an oxidizer, and a metallic cocatalyst; minimized hydrolysis; improved combustion and storage stability OCTANE INTERNATIONAL, LTD. (US) 2009-08-11 US disclosed
EP-0954558-B1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR WILLIAM C (US) 2006-06-14 EP disclosed
US-20050044778-A1 Fuel compositions employing catalyst combustion structure OCTANE INTERNATIONAL, LTD. 2005-03-03 US disclosed
US-20040237384-A1 Fuel compositions exhibiting improved fuel stability OCTANE INTERNATIONAL, LTD. 2004-12-02 US disclosed
US-6652608-B1 Fuel compositions exhibiting improved fuel stability OCTANE INTERNATIONAL, LTD. 2003-11-25 US disclosed
EP-1021388-B1 PHOSPHORYLATION PROCESS AND CATALYST BIONERIS AB (SE) 2003-06-25 EP disclosed
US-6479656-B1 Phosphorylation process and catalyst PERSTORP AB (SE) 2002-11-12 US disclosed
EP-1051461-A2 FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE ORR, William C. (US) 2000-11-15 EP disclosed
WO-1999066009-A2 FUEL COMPOSITIONS EMPLOYING CATALYST COMBUSTION STRUCTURE ORR WILLIAM C (US) 1999-12-23 WO disclosed
EP-0954558-A1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR, William C. (US) 1999-11-10 EP disclosed
US-5919552-A Coated substrates and methods XEROX CORPORATION (US) 1999-07-06 US disclosed
EP-0419018-B1 Silylated lithographic printing plates AGFA GEVAERT NV (BE) 1998-10-28 EP disclosed
WO-1998026028-A1 FUEL COMPOSITIONS EXHIBITING IMPROVED FUEL STABILITY ORR WILLIAM C (US) 1998-06-18 WO disclosed
US-5709976-A Coated papers XEROX CORPORATION (US) 1998-01-20 US disclosed
US-5550001-A Lithographic printing plates containing functional groups capable of reacting with a silane compound DUPONT (U.K.) LIMITED (GB) 1996-08-27 US disclosed
EP-0419018-A2 Improvements in or relating to lithographic printing plates Du Pont (UK) Limited (GB) 1991-03-27 EP disclosed