SCHEMBL6027209

SCHEMBL6027209

CC(C[Al](CC(C)c1ccc2ccccc2c1)CC(C)c1ccc2ccccc2c1)c1ccc2ccccc2c1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
UGT2B7 P16662 1/20 0.55
CYP2D6 P10635 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
CYP1A2 P05177 1/20 0.47
TSHR P16473 1/20 0.47
HIF1A Q16665 1/20 0.47
AOC3 Q16853 2/20 0.44
ATM Q13315 1/20 0.43
ABCB11 O95342 1/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
SLC6A2 P23975 3/20 0.41
SLC6A4 P31645 3/20 0.41
SLC6A3 Q01959 3/20 0.41
CYP3A4 P08684 2/20 0.41
KCNH2 Q12809 2/20 0.41
MMP9 P14780 1/20 0.41

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
SCHEMBL16684715 0.80 UGT2B7 (0.59) UGT2B7CYP2D6MEN1KMT2ACYP1A2
SCHEMBL5401290 0.80 UGT2B7 (0.59) UGT2B7CYP2D6MEN1KMT2ACYP1A2
Hydrochloric Acid SCHEMBL19379618 0.79 SLC6A2 (0.52) UGT2B7CYP2D6MEN1KMT2ACYP1A2
SCHEMBL6678168 0.78 UGT2B7 (0.57) UGT2B7CYP2D6MEN1KMT2ACYP1A2
SCHEMBL74874 0.78 UGT2B7 (0.57) UGT2B7CYP2D6MEN1KMT2ACYP1A2
SCHEMBL30717250 0.78 TAAR1 (0.57) UGT2B7CYP2D6MEN1KMT2ACYP1A2
SCHEMBL6678170 0.78 ABCB11 (0.66) UGT2B7CYP2D6MEN1KMT2ACYP1A2
SCHEMBL1984485 0.78 TAAR1 (0.57) UGT2B7CYP2D6MEN1KMT2ACYP1A2
SCHEMBL13646401 0.78 UGT2B7 (0.57) UGT2B7CYP2D6MEN1KMT2ACYP1A2
Hydrochloric Acid SCHEMBL6559140 0.77 SLC6A2 (0.55) UGT2B7CYP2D6MEN1KMT2ACYP1A2

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-7141527-B1 Catalyst system and process for the polymerization of olefins BASELL POLYOLEFINE GMBH (DE) 2006-11-28 US disclosed
EP-1214364-B1 CATALYST SYSTEM AND PROCESS FOR THE POLYMERIZATION OF OLEFINS BASELL POLYOLEFINE GMBH (DE) 2003-07-16 EP disclosed
EP-1214364-A1 CATALYST SYSTEM AND PROCESS FOR THE POLYMERIZATION OF OLEFINS Basell Technology Company B.V. (NL) 2002-06-19 EP disclosed
WO-2001021674-A1 CATALYST SYSTEM AND PROCESS FOR THE POLYMERIZATION OF OLEFINS BASELL TECHNOLOGY COMPANY B.V. (NL) 2001-03-29 WO disclosed