SCHEMBL869351

SCHEMBL869351

c1ccc(C2(C3(c4ccccc4)CCCC3)CCCC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.50
AKR1C1 Q04828 1/20 0.50
GRIN2D O15399 1/20 0.46
GRIN3B O60391 1/20 0.46
CYP2B6 P20813 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
PRCP P42785 1/20 0.46
SLC6A3 Q01959 1/20 0.46
GRIN1 Q05586 1/20 0.46
KCNH2 Q12809 1/20 0.46
GRIN2A Q12879 1/20 0.46
GRIN2B Q13224 1/20 0.46
GRIN2C Q14957 1/20 0.46
GRIN3A Q8TCU5 1/20 0.46
SIGMAR1 Q99720 1/20 0.46
OPRM1 P35372 2/20 0.45
OPRD1 P41143 1/20 0.45
OPRK1 P41145 1/20 0.44
OPRL1 P41146 1/20 0.44

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
SCHEMBL868923 0.97 SLC6A4 (0.50) DPP4AKR1C1GRIN2DGRIN3BCYP2B6
SCHEMBL9508534 0.81 AKR1C1 (0.45) DPP4AKR1C1GRIN2DGRIN3BCYP2B6
SCHEMBL930218 0.81 SLC6A4 (0.44) DPP4AKR1C1GRIN2DGRIN3BCYP2B6
SCHEMBL19265008 0.78 AKR1C1 (0.42) DPP4AKR1C1SLC6A2SLC6A3HDAC4
SCHEMBL827795 0.77 OPRM1 (0.61) DPP4AKR1C1GRIN2DGRIN3BGRIN1
Hydrochloric Acid SCHEMBL10323225 0.76 SLC6A4 (0.39) DPP4AKR1C1GRIN2DGRIN3BCYP2B6
SCHEMBL10346570 0.76 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3GRIN1GRIN2A
SCHEMBL28362050 0.76 AKR1C1 (0.55) AKR1C1HDAC4
SCHEMBL24157288 0.74 ESR1 (0.58) GRIN2DGRIN3BCYP2B6SLC6A2SLC6A4
SCHEMBL30877902 0.74 ESR1 (0.58) GRIN2DGRIN3BCYP2B6SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7585912-B2 Flame-retardant polystyrenes BROMINE COMPOUNDS LTD. (IL) 2009-09-08 US claimed
EP-1786853-B1 NOVEL FLAME-RETARDANT POLYSTYRENES BROMINE COMPOUNDS LTD (IL) 2009-04-15 EP claimed
JP-2008506829-A 2008-03-06 JP claimed
US-20070257241-A1 Novel Flame-Retardant Polystyrenes BROMINE COMPOUNDS LTD. (IL) 2007-11-08 US claimed
EP-1786853-A1 NOVEL FLAME-RETARDANT POLYSTYRENES Bromine Compounds Ltd. (IL) 2007-05-23 EP claimed
WO-2006013554-A1 NOVEL FLAME-RETARDANT POLYSTYRENES BROMINE COMPOUNDS LTD. (IL) 2006-02-09 WO claimed
US-6967229-B2 Carbon-carbon initiators for use in golf balls ACUSHNET COMPANY (US) 2005-11-22 US claimed
US-20050009992-A1 Carbon-carbon initiators for use in golf balls JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2005-01-13 US claimed
US-9056227-B2 Golf ball comprising a core having a shallow hardness gradient ACUSHNET COMPANY (US) 2015-06-16 US disclosed
US-8968117-B2 Dual-core comprising zero gradient center and positive gradient outer core layer ACUSHNET COMPANY (US) 2015-03-03 US disclosed
EP-2387578-B1 EXTRUDED POLYMER FOAMS CONTAINING ESTERS OF A SUGAR AND A BROMINATED FATTY ACID AS A FLAME RETARDANT ADDITIVE DOW GLOBAL TECHNOLOGIES LLC (US) 2014-06-11 EP disclosed
US-8450383-B2 Extruded polymer foams containing esters of a sugar and a brominated fatty acid as a flame retardant additive DOW GLOBAL TECHNOLOGIES LLC (US) 2013-05-28 US disclosed
US-20130109506-A1 GOLF BALL COMPRISING A CORE HAVING A SHALLOW HARDNESS GRADIENT ACUSHNET COMPANY (US) 2013-05-02 US disclosed
US-20130109504-A1 DUAL-CORE COMPRISING ZERO GRADIENT CENTER AND POSITIVE GRADIENT OUTER CORE LAYER ACUSHNET COMPANY (US) 2013-05-02 US disclosed
WO-1993012163-A1 FIRE RESISTANT ALKENYLAROMATIC FOAMS THE DOW CHEMICAL COMPANY (US) 1993-06-24 WO disclosed
US-5171757-A Consists of polymer, at least one brominated aliphatic and other brominated compounds having higher volatization temperature and heat stability and melt flow promoter THE DOW CHEMICAL COMPANY (US) 1992-12-15 US disclosed
US-5160784-A Fire-resistant thermoplastic composite structure THE DOW CHEMICAL COMPANY (US) 1992-11-03 US disclosed
EP-0004050-B2 FLAME-PROTECTED EXPANDABLE STYRENE POLYMERS USEFUL IN FOAM PREPARATION BASF Aktiengesellschaft (DE) 1986-09-10 EP disclosed
EP-0004050-B1 FLAME-PROTECTED EXPANDABLE STYRENE POLYMERS USEFUL IN FOAM PREPARATION BASF Aktiengesellschaft (DE) 1981-11-25 EP disclosed
US-4272583-A Flameproofed expandable styrene polymers BASF AKTIENGESELLSCHAFT (US) 1981-06-09 US disclosed