SCHEMBL2231996

SCHEMBL2231996

CCCCC(CC)CO[SiH](CCl)OCC(CC)CCCC

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 6/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
TSHR P16473 4/20 0.44
TDP1 Q9NUW8 3/20 0.44
ATM Q13315 1/20 0.44
ALDH1A1 P00352 8/20 0.43
CA2 P00918 3/20 0.39
RECQL P46063 1/20 0.37
LMNA P02545 2/20 0.36
MMP9 P14780 1/20 0.36
MMP8 P22894 1/20 0.36
MMP14 P50281 1/20 0.36
MAPK1 P28482 2/20 0.35
HSD17B10 Q99714 1/20 0.35
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34

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
SCHEMBL1779633 0.81 CYP3A4 (0.53) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL28636947 0.76 CYP3A4 (0.48) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL27344874 0.75 CYP3A4 (0.58) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL6838188 0.74 TSHR (0.45) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL27632898 0.74 CYP3A4 (0.55) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL1396015 0.74 CYP3A4 (0.62) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL13354384 0.74 CYP3A4 (0.62) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL13007651 0.74 CYP3A4 (0.62) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL6434315 0.73 CYP3A4 (0.50) CYP3A4L3MBTL1TSHRTDP1ATM
SCHEMBL5198521 0.73 CYP3A4 (0.59) CYP3A4L3MBTL1TSHRTDP1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0447066-B2 Pneumatic tyres BRIDGESTONE CORP (JP) 2000-08-16 EP claimed
US-5409969-A Comprising silica filler, carbon black, silane coupler, living polymer of butadiene-styrene BRIDGESTONE CORPORATION (JP) 1995-04-25 US claimed
EP-0447066-A1 Pneumatic tyres Bridgestone Corporation (JP) 1991-09-18 EP claimed
US-5017636-A Also containing polyisoprene, natural rubber, butadiene-styrene copolymer, wear and heat resistance, resilience JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1991-05-21 US claimed
EP-1721930-B1 RUBBER COMPOSITION JSR CORP (JP) 2015-01-28 EP disclosed
US-7981966-B2 Rubber composition JSR CORPORATION (JP) 2011-07-19 US disclosed
US-20070208126-A1 Vulcanizable rubber composition, in particular for low rolling resistance treads of vehicle tires PIRELLI PNEUMATICI S.P.A. 2007-09-06 US disclosed
US-20070185267-A1 Rubber composition JSR CORPORATION (JP) 2007-08-09 US disclosed
EP-1721930-A1 RUBBER COMPOSITION JSR Corporation (JP) 2006-11-15 EP disclosed
EP-0992537-B1 Oil extended rubber and rubber composition JSR CORP (JP) 2004-12-29 EP disclosed
US-20040220324-A1 First modified conjugated diolefin-vinylaromatic copolymer; second conjugated diolefin-vinylaromatic copolymer; first carbon black-based reinforcing filler; second silica-based reinforcing filler PIRELLI PNEUMATICI S.P.A. 2004-11-04 US disclosed
EP-0972790-B1 Process for producing a vulcanizable rubber composition including carbon black-based and silicia-based reinforcing fillers PIRELLI (IT) 2004-09-22 EP disclosed
EP-1000970-A1 Polymodal conjugated diolefin vinyl aromate rubber composition JSR Corporation (JP) 2000-05-17 EP disclosed
EP-0992537-A1 Oil extended rubber and rubber composition JSR Corporation (JP) 2000-04-12 EP disclosed
EP-0972790-A1 Process for producing a vulcanizable rubber composition including carbon black-based and silicia-based reinforcing fillers PIRELLI PNEUMATICI Società per Azioni (IT) 2000-01-19 EP disclosed
EP-0934973-A1 Vulcanizable rubber composition, in particular for low rolling resistance treads of vehicle tires PIRELLI PNEUMATICI S.p.A. (IT) 1999-08-11 EP disclosed
US-5496883-A COMPRISING TREAD RUBBER OF POLYBUTADIENE POLYMER OR COPOLYMER CONTAINING SILICA AND MODIFIED WITH SILANE COUPLING AGENT; COUPLING AGENT; WET SKID RESISTANCE, LOW ROLLLING RESISTANCE BRIDGESTONE CORPORATION (JP) 1996-03-05 US disclosed
US-5409969-A Comprising silica filler, carbon black, silane coupler, living polymer of butadiene-styrene BRIDGESTONE CORPORATION (JP) 1995-04-25 US disclosed
EP-0447066-A1 Pneumatic tyres Bridgestone Corporation (JP) 1991-09-18 EP disclosed
US-5017636-A Also containing polyisoprene, natural rubber, butadiene-styrene copolymer, wear and heat resistance, resilience JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1991-05-21 US disclosed