SCHEMBL6455196

SCHEMBL6455196

CC1=C2c3c(ccn3-c3ccccc3)C1[Si]2(C)C

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.35
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34
COMT P21964 1/20 0.34
ATM Q13315 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
HPGD P15428 1/20 0.30
BLM P54132 1/20 0.30
HSD17B10 Q99714 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
Hydrochloric Acid SCHEMBL5949043 0.83
Hydrochloric Acid SCHEMBL5948504 0.83
SCHEMBL6459600 0.79
SCHEMBL6455143 0.79
Hydrochloric Acid SCHEMBL5948253 0.78
Hydrochloric Acid SCHEMBL2518439 0.76
Hydrochloric Acid SCHEMBL2514585 0.76
SCHEMBL6445950 0.74 ALDH1A1 (0.36) NOTUMSMN1; SMN2KDM4EALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL6065770 0.74
Hydrochloric Acid SCHEMBL6065625 0.74

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-1053263-B1 CATALYST SYSTEM BASELL POLYOLEFINE GMBH (DE) 2003-10-01 EP claimed
US-6949614-B1 Catalyst system BASELL POLYOLEFINE GMBH (DE) 2005-09-27 US disclosed
EP-1054914-B1 ZWITTERIONIC, NEUTRAL TRANSITION METAL COMPOUND BASELL POLYOLEFINE GMBH (DE) 2004-03-03 EP disclosed
EP-1290002-B1 CHEMICAL PRODUCTS SUITED FOR USE AS CO-CATALYSTS, METHOD FOR THE PREPARATION THEREOF AND THEIR USE IN CATALYST SYSTEMS FOR PRODUCING POLYOLEFINS BASELL POLYOLEFINE GMBH (DE) 2004-01-21 EP disclosed