SCHEMBL7598786

SCHEMBL7598786

CCC1=C2c3c(-c4ccccc4)cccc3C1[Zr](C)(C)C1C(CC)=C(c3c(-c4ccccc4)cccc31)C2(C)C

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.30
HTR7 P34969 2/20 0.30
HTR2B P41595 2/20 0.30
TMEM97 Q5BJF2 2/20 0.30
SIGMAR1 Q99720 2/20 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
SCHEMBL797081 0.84 SOAT1 (0.30)
SCHEMBL7602972 0.82 PDCD1 (0.34) HTR1AHTR7HTR2BTMEM97SIGMAR1
SCHEMBL7602958 0.82 HTT (0.32)
SCHEMBL7598778 0.80 BRD4 (0.33) HTR1AHTR7
SCHEMBL7602016 0.79 HTR1A (0.33) HTR1AHTR7HTR2BTMEM97SIGMAR1
SCHEMBL7602562 0.77 HTR1A (0.34) HTR1AHTR7HTR2BTMEM97SIGMAR1
SCHEMBL7599210 0.77
SCHEMBL7596519 0.76
SCHEMBL797306 0.74 SOAT1 (0.30) HTR1AHTR7HTR2BTMEM97SIGMAR1
SCHEMBL797644 0.73 GCGR (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6410665-B1 POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN BASELL POLYOLEFINE GMBH (DE) 2002-06-25 US claimed
US-6410665-B1 POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN BASELL POLYOLEFINE GMBH (DE) 2002-06-25 US disclosed