SCHEMBL6560000

SCHEMBL6560000

Cc1cccc(C2CCCCN2OC(=O)NC(C)(C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 4/20 0.40
WDR77 Q9BQA1 4/20 0.40
RIPK1 Q13546 1/20 0.39
CCKBR P32239 1/20 0.38
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
MAOB P27338 3/20 0.37
GPR119 Q8TDV5 1/20 0.37
ROCK2 O75116 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAOA P21397 2/20 0.37
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
DRD3 P35462 1/20 0.36
OPRK1 P41145 1/20 0.36

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
SCHEMBL6560857 0.97 RIPK1 (0.42) RIPK1CCKBRLMNAMAOBGPR119
SCHEMBL22055802 0.72 ALDH1A1 (0.48) MAPTMAOBROCK2ALDH1A1MAOA
SCHEMBL27341297 0.71 PRMT5 (0.49) PRMT5WDR77RIPK1ROCK2
SCHEMBL30009641 0.70 AKR1C3 (0.36) LMNAALDH1A1
SCHEMBL878861 0.70 NPSR1 (0.56) RIPK1LMNAMAPTGPR119ROCK2
SCHEMBL6559996 0.70 RIPK1 (0.46) PRMT5WDR77RIPK1MAPTMAOB
SCHEMBL28065011 0.69 CFB (0.44) RIPK1LMNAROCK2ALDH1A1DRD2
SCHEMBL14948763 0.69 CHRNB2 (0.59) LMNAMAPTMAOBALDH1A1DRD2
SCHEMBL6558731 0.67 SMN1; SMN2 (0.34) LMNAALDH1A1
SCHEMBL24365462 0.67 PRMT5 (0.85) PRMT5WDR77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0926164-B1 Substituted amino silane compounds and catalyst for the polymerization of alpha-olefins containing them BASELL NORTH AMERICA INC (US) 2004-02-25 EP disclosed
US-6130180-A Catalyst for the polymerization of alpha-olefins containing substituted amino silane compounds MONTELL NORTH AMERICA INC. (US) 2000-10-10 US disclosed
EP-0926164-A2 Substituted amino silane compounds and catalyst for the polymerization of alpha-olefins containing them MONTELL NORTH AMERICA INC. (US) 1999-06-30 EP disclosed