SCHEMBL7935709

SCHEMBL7935709

CC1C([Si](C)(C)NC(C)(C)C)=Cc2c1ccc1c2ccc2ccccc21

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 1/20 0.35
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 2/20 0.30
CYP2A6 P11509 1/20 0.30
TSHR P16473 1/20 0.30
HSD17B10 Q99714 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
LMNA P02545 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
APEX1 P27695 1/20 0.30
MAPK1 P28482 1/20 0.30
PMP22 Q01453 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
SCHEMBL7926994 0.75 HPRT1 (0.35) HPRT1ALDH1A1CYP2A6TSHRHSD17B10
SCHEMBL6433626 0.73 HPRT1 (0.36) HPRT1KDM4EALDH1A1CYP2A6TSHR
Hydrochloric Acid SCHEMBL7926903 0.71 HPRT1 (0.33) HPRT1KDM4ETDP1
SCHEMBL8194253 0.68 ALDH1A1 (0.42) HPRT1KDM4EALDH1A1CYP2A6TSHR
SCHEMBL7630738 0.66 HPRT1 (0.42) HPRT1KDM4EALDH1A1CYP2A6TSHR
SCHEMBL7951420 0.64 HPRT1 (0.32) HPRT1
SCHEMBL7926905 0.63 HPRT1 (0.36) HPRT1KDM4EALDH1A1CYP2A6TSHR
SCHEMBL7637891 0.63 HPRT1 (0.39) HPRT1KDM4EALDH1A1CYP2A6TSHR
SCHEMBL7629651 0.62 HPRT1 (0.45) HPRT1KDM4EALDH1A1CYP2A6TSHR
SCHEMBL25471782 0.60 MYB (0.43) HPRT1KDM4EALDH1A1CYP2A6TSHR

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
US-6329486-B1 PHYSICAL PROPERTIES THE DOW CHEMICAL COMPANY 2001-12-11 US disclosed
US-6323294-B1 CONTACTING C.SUB.2-100,000 OLEFIN/S UNDER POLYMERIZATION CONDITIONS WITH CATALYST SYSTEM COMPRISING METAL COMPLEX AND ACTIVATING COCATALYST OR REACTION PRODUCT OF METAL COMPLEX AND COCATALYST TO FORM ADDITION POLYMER THE DOW CHEMICAL COMPANY 2001-11-27 US disclosed
EP-1017701-A1 CYCLOPENTAPHENANTHRENEYL METAL COMPLEXES AND POLYMERIZATION PROCESS THE DOW CHEMICAL COMPANY (US) 2000-07-12 EP disclosed
WO-1999014221-A1 CYCLOPENTAPHENANTHRENEYL METAL COMPLEXES AND POLYMERIZATION PROCESS THE DOW CHEMICAL COMPANY (US) 1999-03-25 WO disclosed