SCHEMBL7188601

SCHEMBL7188601

CC1=Cc2c(-c3ccc4ccccc4c3)cccc2C1[Zr](C)(C)(=[SiH2])C1C(C)=Cc2c(-c3ccc4ccccc4c3)cccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSTP1 P09211 1/20 0.36
HDAC4 P56524 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
DHFR P00374 1/20 0.33
MET P08581 1/20 0.32
PIM1 P11309 1/20 0.32
HSD17B1 P14061 1/20 0.32
HSD17B2 P37059 1/20 0.32
AKT1 P31749 1/20 0.32
ADORA2A P29274 1/20 0.32
ADORA1 P30542 1/20 0.32
S1PR5 Q9H228 2/20 0.31
HSD11B1 P28845 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31

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
Hydrochloric Acid SCHEMBL4064327 0.99 GSTP1 (0.36) GSTP1HDAC4HDAC2HDAC8SLC6A2
Hydrochloric Acid SCHEMBL3399895 0.90 GSTP1 (0.30) GSTP1
SCHEMBL5359556 0.85 GSTP1 (0.35) GSTP1HDAC4HDAC2HDAC8SLC6A2
Hydrochloric Acid SCHEMBL2512462 0.84 GSTP1 (0.34) GSTP1HDAC4HDAC2HDAC8SLC6A2
SCHEMBL2561824 0.84 PDCD1 (0.33)
Hydrochloric Acid SCHEMBL1023669 0.83 HDAC4 (0.31) HDAC4HDAC2HDAC8
SCHEMBL27430402 0.83 CHEK1 (0.33) METPIM1ADORA1ALDH1A1SMN1; SMN2
Hydrochloric Acid SCHEMBL6436500 0.82 PDCD1 (0.32)
Hydrochloric Acid SCHEMBL271771 0.82 PDCD1 (0.32)
Fluoride SCHEMBL7638687 0.82 PDCD1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0836624-B1 METHOD FOR PRODUCING PREPOLYMERIZED, SUPPORTED METALLOCENE CATALYST SYSTEMS EXXONMOBIL CHEM PATENTS INC (US) 2002-04-17 EP claimed
US-6583227-B2 Crystalline homo/copolymers prepared using sequential or parallel metallocene dual catalyst system; broad, bimodal molecular weight distribution; biaxially oriented and non-oriented films; even stretch at low temperature EXXONMOBIL CHEMICAL PATENTS INC. 2003-06-24 US disclosed
US-20010044506-A1 Crystalline homo/copolymers prepared using sequential or parallel metallocene dual catalyst system; broad, bimodal molecular weight distribution; biaxially oriented and non-oriented films; even stretch at low temperature EXXONMOBIL CHEMICAL PATENTS INC. 2001-11-22 US disclosed
CN-1116852-A Propylene elastomer MITSUI PETROCHEMICAL IND (JP) 1996-02-14 CN disclosed