SCHEMBL7705069

SCHEMBL7705069

CC1=Cc2ccc(-c3ccccc3)cc2C1[Zr](Cl)Cl

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 2/20 0.32
TMEM97 Q5BJF2 2/20 0.32
SIGMAR1 Q99720 2/20 0.32
HTR1A P08908 1/20 0.32
ESR2 Q92731 1/20 0.32
HTR7 P34969 1/20 0.32
PGR P06401 1/20 0.31
ALOX5 P09917 1/20 0.31
CYP1A2 P05177 1/20 0.31
NPC1 O15118 2/20 0.30
GAA P10253 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
RAB9A P51151 1/20 0.30
HTR2C P28335 1/20 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
SCHEMBL4094394 0.88 MGLL (0.33) ESR2PGRALOX5CYP1A2NPC1
SCHEMBL29085643 0.78 CYP19A1 (0.31)
SCHEMBL812104 0.78 CYP19A1 (0.31)
Hydrochloric Acid SCHEMBL7705066 0.74 GAA (0.33) HTR2BTMEM97SIGMAR1HTR1AHTR7
SCHEMBL1454121 0.74 HTR2C (0.34) HTR2BTMEM97SIGMAR1HTR1AALOX5
SCHEMBL1452154 0.74 HTR2C (0.34) HTR2BTMEM97SIGMAR1HTR1AHTR7
SCHEMBL1453031 0.73 HTR2C (0.33) HTR2BTMEM97SIGMAR1HTR1AALOX5
SCHEMBL4652087 0.73 L3MBTL1 (0.32) HTR2BTMEM97SIGMAR1HTR1AALOX5
SCHEMBL1454234 0.73 GAA (0.37) HTR2BTMEM97SIGMAR1HTR1AHTR7
SCHEMBL8382207 0.71

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-RE37573-E1 Process for the preparation of an olefin polymer using metallocenes containing specifically substituted indenyl ligands BASELL POLYOLEFIN GMBH (DE) 2002-03-05 US disclosed
US-5455365-A Metallocene compound containing substituted indenyl ligand and transition metal element from groups IVb, Vb, or VIb; addition polymerization with aluminoxane cocatalyst HOECHST AG (DE) 1995-10-03 US disclosed