SCHEMBL3672744

SCHEMBL3672744

CC(C)C1=C(c2cccc3ccccc23)c2ccccc2C1[Zr](C1C(C(C)C)=C(c2cccc3ccccc23)c2ccccc21)[SiH](C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ALOX5 P09917 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TDP2 O95551 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
ALOX12 P18054 1/20 0.33
MAPK1 P28482 1/20 0.33
CASP3 P42574 1/20 0.33
HTT P42858 1/20 0.33
GALK1 P51570 1/20 0.33
BLM P54132 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
KDM4C Q9H3R0 1/20 0.33

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
SCHEMBL2232977 0.85 ALDH1A1 (0.35) MAPTNPC1RAB9ASMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL2236336 0.84 ALDH1A1 (0.34) MAPTNPC1RAB9ASMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL3673543 0.75 NPC1 (0.35) MAPTNPC1RAB9ASMN1; SMN2ALOX5
SCHEMBL3672745 0.74 MAPT (0.34) MAPTNPC1RAB9ASMN1; SMN2ALOX5
SCHEMBL5890238 0.73 MAPT (0.34) MAPTNPC1RAB9ASMN1; SMN2ALOX5
SCHEMBL8679845 0.72 ALDH1A1 (0.36) MAPTNPC1RAB9ASMN1; SMN2KDM4E
Hydrochloric Acid SCHEMBL7933117 0.71 ALOX5 (0.35) MAPTNPC1RAB9ASMN1; SMN2ALOX5
Hydrochloric Acid SCHEMBL7936151 0.70 NPC1 (0.33) MAPTNPC1RAB9ASMN1; SMN2ALOX5
Hydrochloric Acid SCHEMBL7933167 0.70 ALOX5 (0.34) MAPTNPC1RAB9ASMN1; SMN2ALOX5
Hydrochloric Acid SCHEMBL7935514 0.70 NPC1 (0.33) MAPTNPC1RAB9ASMN1; SMN2ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7807769-B2 Isotactic polypropylene produced from supercritical polymerization process EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-10-05 US claimed
EP-2231726-A1 ISOTACTIC POLYPROPYLENE PRODUCED FROM SUPERCRITICAL POLYMERIZATION PROCESS ExxonMobil Chemical Patents Inc. (US) 2010-09-29 EP claimed
WO-2009123663-A1 ISOTACTIC POLYPROPYLENE PRODUCED FROM SUPERCRITICAL POLYMERIZATION PROCESS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-10-08 WO claimed
US-20080214767-A1 Isotactic Polypropylene Produced From Supercritical Polymerization Process EXXONMOBIL CHEMICAL PATENTS INC. 2008-09-04 US claimed
US-7807769-B2 Isotactic polypropylene produced from supercritical polymerization process EXXONMOBIL CHEMICAL PATENTS INC. (US) 2010-10-05 US disclosed
EP-2231726-A1 ISOTACTIC POLYPROPYLENE PRODUCED FROM SUPERCRITICAL POLYMERIZATION PROCESS ExxonMobil Chemical Patents Inc. (US) 2010-09-29 EP disclosed
WO-2009123663-A1 ISOTACTIC POLYPROPYLENE PRODUCED FROM SUPERCRITICAL POLYMERIZATION PROCESS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-10-08 WO disclosed
US-20080214767-A1 Isotactic Polypropylene Produced From Supercritical Polymerization Process EXXONMOBIL CHEMICAL PATENTS INC. 2008-09-04 US disclosed