SCHEMBL6560546

SCHEMBL6560546

CN(C)c1cccc(CCC[AlH]Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 1/20 0.45
▸ NOS1 P29475 2/20 0.43
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ KMT2A Q03164 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ SIGMAR1 Q99720 2/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ TSHR P16473 2/20 0.39
▸ APP P05067 1/20 0.38
▸ TAAR1 Q96RJ0 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ AOC3 Q16853 2/20 0.36
▸ CHKA P35790 2/20 0.36
▸ CYP3A4 P08684 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL10356301 0.79 LPL (0.46) CNR1HDAC1HDAC6KMT2AL3MBTL1
SCHEMBL11404905 0.77 KMT2A (0.43) CNR1NOS1HDAC1HDAC6KMT2A
SCHEMBL8374276 0.77 ALDH1A1 (0.47) CNR1NOS1HDAC1HDAC6KMT2A
SCHEMBL6750529 0.77 CALM1 (0.53) CNR1NOS1HDAC1HDAC6KMT2A
Hydrochloric Acid SCHEMBL6560552 0.76 KMT2A (0.42) CNR1NOS1HDAC1HDAC6KMT2A
SCHEMBL7027687 0.76 CYP4F2 (0.50) CNR1NOS1HDAC1HDAC6KMT2A
SCHEMBL7027684 0.75 L3MBTL1 (0.41) CNR1NOS1HDAC1HDAC6KMT2A
SCHEMBL15618416 0.75 BCHE (0.49) CNR1HDAC1HDAC6KMT2AL3MBTL1
SCHEMBL169805 0.74 ALDH1A1 (0.47) CNR1NOS1HDAC1HDAC6KMT2A
SCHEMBL7027577 0.73 SIGMAR1 (0.42) CNR1NOS1HDAC1HDAC6KMT2A

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
EP-1132409-B1 Catalyst systems for the Ziegler-Natta-Olefin-Polymerisation MERCK PATENT GMBH (DE) 2004-06-30 — — EP claimed
US-6534606-B2 Aluminium alkyl complexes applied to magnesium chloride and/or silicon dioxide as support in the presence of titanium or vanadium halides and donors act as cocatalysts and stereoselectivity promoters MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 2003-03-18 — — US claimed
US-20020173603-A1 Catalyst system for the Ziegler-Natta polymerization of olefins MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 2002-11-21 — — US claimed
US-6534606-B2 Aluminium alkyl complexes applied to magnesium chloride and/or silicon dioxide as support in the presence of titanium or vanadium halides and donors act as cocatalysts and stereoselectivity promoters MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 2003-03-18 — — US disclosed
US-20020173603-A1 Catalyst system for the Ziegler-Natta polymerization of olefins MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 2002-11-21 — — US disclosed
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