SCHEMBL7530228

SCHEMBL7530228

C[CH]c1ccc(CCCCCCCCC)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.59
ADRA2A P08913 2/20 0.59
ADORA3 P0DMS8 2/20 0.59
TACR2 P21452 2/20 0.59
SLC6A2 P23975 2/20 0.59
SLC6A4 P31645 2/20 0.59
SLC6A3 Q01959 2/20 0.59
CYP3A4 P08684 2/20 0.59
HSD17B10 Q99714 2/20 0.59
ALDH1A1 P00352 2/20 0.59
KDM4E B2RXH2 1/20 0.59
LMNA P02545 1/20 0.59
SHBG P04278 1/20 0.59
TP53 P04637 1/20 0.59
HSPD1 P10809 1/20 0.59
ADRB3 P13945 1/20 0.59
HTR2C P28335 1/20 0.59
HSPE1 P61604 1/20 0.59
HIF1A Q16665 1/20 0.59
TST Q16762 1/20 0.59

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
SCHEMBL1611470 1.00 ESR1 (0.59) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL698307 1.00 ESR1 (0.59) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL2915274 1.00 ESR1 (0.59) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL9753197 1.00 ESR1 (0.59) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL677468 1.00 ESR1 (0.59) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL1609473 0.98 ESR1 (0.55) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL329513 0.91 CA2 (0.50) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL8371449 0.86 ESR1 (0.57) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL27929252 0.86 ESR1 (0.57) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL17160009 0.86 ESR1 (0.57) ESR1ADRA2AADORA3TACR2SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1008429-B1 Paintable organopolysiloxane mold release compositions WACKER CHEMIE GMBH (DE) 2002-04-03 EP disclosed
US-6294007-B1 STABILITY WACKER SILICONES CORPORATION 2001-09-25 US disclosed
US-6194482-B1 CASTING RESIN OF EPOXY RESIN, ISOCYANURATE SILOXANE, FILLERS, PHOTO INITIATORS AND THERMAL INITIATORS SIEMENS AKTIENGESELLSCHAFT (DE) 2001-02-27 US disclosed
EP-1008429-A1 Paintable organopolysiloxane mold release compositions and processes for their use Wacker-Chemie GmbH (DE) 2000-06-14 EP disclosed
US-6037043-A UV-hardenable and thermally hardenable epoxy resins for underfilling electrical and electronic components SIEMENS AKTIENGESELLSCAFT (DE) 2000-03-14 US disclosed
EP-0523468-B1 Silicone imides SIEMENS AG (DE) 1996-10-09 EP disclosed
EP-0399199-B1 Silicone compounds containing isocyanurat groups SIEMENS AG (DE) 1994-07-27 EP disclosed
US-5302684-A Siliconimides SIEMENS AKTIENGESELLSCHAFT (DE) 1994-04-12 US disclosed
US-5239073-A Preparation of isocyanurate-containing organosilicon compounds SIEMENS AKTIENGESELLSCHAFT (DE) 1993-08-24 US disclosed
EP-0523468-A1 Silicone imides SIEMENS AKTIENGESELLSCHAFT (DE) 1993-01-20 EP disclosed
US-5101029-A ISOCYANURATE-CONTAINING ORGANOSILICON COMPOUNDS SIEMENS AKTIENGESELLSCHAFT (DE) 1992-03-31 US disclosed
EP-0399199-A2 Silicone compounds containing isocyanurat groups SIEMENS AKTIENGESELLSCHAFT (DE) 1990-11-28 EP disclosed
US-4969711-A Optical glass fiber with a primary coating of acrylic acid ester groups-containing organo-polysiloxanes SIEMENS AKTIENGESELLSCHAFT (DE) 1990-11-13 US disclosed