SCHEMBL2531891

SCHEMBL2531891

CC=[Ti](Cl)(Cl)(C1C(C)=Cc2c(-c3ccc4ccccc4c3)cccc21)C1C(C)=Cc2c(-c3ccc4ccccc4c3)cccc21

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GSTP1 P09211 1/20 0.34
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC8 Q9BY41 1/20 0.33
DHFR P00374 1/20 0.32
MET P08581 1/20 0.31
HSD17B1 P14061 1/20 0.30
HSD17B2 P37059 1/20 0.30
AKT1 P31749 1/20 0.30

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
SCHEMBL2539857 0.86 GSTP1 (0.34) GSTP1SLC6A2SLC6A4SLC6A3HDAC4
SCHEMBL819030 0.85 PDCD1 (0.30)
SCHEMBL820022 0.81 CA12 (0.31) DHFR
Hydrochloric Acid SCHEMBL2539859 0.81 GSTP1 (0.36) GSTP1SLC6A2SLC6A4SLC6A3HDAC4
SCHEMBL7601711 0.78 GSTP1 (0.37) GSTP1SLC6A2SLC6A4SLC6A3HDAC4
SCHEMBL5952835 0.78 GSTP1 (0.37) GSTP1SLC6A2SLC6A4SLC6A3HDAC4
SCHEMBL28941567 0.76 GSTP1 (0.38) GSTP1SLC6A2SLC6A4SLC6A3HDAC4
SCHEMBL7940308 0.76 GSTP1 (0.44) GSTP1SLC6A2SLC6A4SLC6A3HDAC4
SCHEMBL2535197 0.75
Hydrochloric Acid SCHEMBL7601708 0.75 GSTP1 (0.39) GSTP1SLC6A2SLC6A4SLC6A3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8044144-B2 Resin composition, transparent film or sheet having elasticity recovering property, and wrap film PRIME POLYMER CO., LTD. (JP) 2011-10-25 US disclosed
US-20090012238-A1 RESIN COMPOSITION, TRANSPARENT FILM OR SHEET HAVING ELASTICITY RECOVERING PROPERTY, AND WRAP FILM PRIME POLYMER CO., LTD (JP) 2009-01-08 US disclosed
US-7259215-B2 Process for producing propylene/ethylene block copolymer and propylene/ethylene block copolymer IDEMITSU KOSAN CO., LTD. (JP) 2007-08-21 US disclosed
US-20060014909-A1 Process for producing propylene/ethylene block copolymer and propylene/ethylene block copolymer IDEMITSU KOSAN CO., LTD. (JP) 2006-01-19 US disclosed
EP-1561762-A1 PROCESS FOR PRODUCING PROPYLENE/ETHYLENE BLOCK COPOLYMER AND PROPYLENE/ETHYLENE BLOCK COPOLYMER IDEMITSU KOSAN COMPANY LIMITED (JP) 2005-08-10 EP disclosed