SCHEMBL6055554

SCHEMBL6055554

CC1=C(C)C(C)([Cr](Cl)Cl)C(c2cccc3cccnc23)=C1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 4/20 0.40
CCR8 P51685 4/20 0.40
MAPT P10636 4/20 0.40
CCR5 P51681 3/20 0.40
KDM4E B2RXH2 3/20 0.40
TDP1 Q9NUW8 3/20 0.40
LMNA P02545 3/20 0.40
HTT P42858 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
MMP2 P08253 2/20 0.40
TSHR P16473 2/20 0.40
GMNN O75496 1/20 0.40
TP53 P04637 1/20 0.40
HSP90AA1 P07900 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
MMP9 P14780 1/20 0.40
ALOX15 P16050 1/20 0.40
NFKB1 P19838 1/20 0.40
MMP8 P22894 1/20 0.40

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
SCHEMBL7194074 0.80 CCR1 (0.44) CCR1CCR8MAPTCCR5KDM4E
Hydrochloric Acid SCHEMBL1072939 0.79 KDM4E (0.43) CCR1CCR8MAPTCCR5KDM4E
SCHEMBL6292389 0.79 CCR1 (0.43) CCR1CCR8MAPTCCR5KDM4E
SCHEMBL6131348 0.78 CCR1 (0.42) CCR1CCR8MAPTCCR5KDM4E
Hydrochloric Acid SCHEMBL535776 0.74 CCR1 (0.41) CCR1CCR8MAPTCCR5KDM4E
SCHEMBL6055552 0.71 MAPT (0.40) CCR1CCR8MAPTCCR5KDM4E
SCHEMBL5270900 0.70 CCR1 (0.40) CCR1CCR8MAPTCCR5KDM4E
Hydrochloric Acid SCHEMBL3081477 0.69 CCR1 (0.39) CCR1CCR8MAPTCCR5KDM4E
SCHEMBL1282008 0.68 CCR1 (0.75) CCR1CCR8MAPTCCR5KDM4E
SCHEMBL30184687 0.68 CCR1 (0.75) CCR1CCR8MAPTCCR5KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7094724-B2 Catalytic solid supported on calcined hydrotalcite for olefinic polymerisation BASSELL POLYELEFINE GMBH (DE) 2006-08-22 US disclosed
US-6924248-B2 Catalyst system for carrying out olefin polymerization comprising a calcined hydro-talcite serving as a supporting material BASELL POLYOLEFINE GMBH (DE) 2005-08-02 US disclosed
US-6919412-B1 Monocyclopentadienyl complexes of chromium, molybdenum or tungsten with a donor bridge BASELL POLYOLEFINE GMBH (DE) 2005-07-19 US disclosed
US-20040033890-A1 Catalyst system for carrying out olefin polymerization comprising a calcined hydro-talcite serving as a supporting material LYONDELL CHEMICAL TECHNOLOGY, L.P. 2004-02-19 US disclosed
US-20030176275-A1 Catalytic solid supported on calcined hydrotalcite for olefinic polymerisation BASELL POLYOLEFINE GMBH (DE) 2003-09-18 US disclosed