SCHEMBL7199373

SCHEMBL7199373

CC1=Cc2c(-c3ccc(F)cc3)cccc2C1[Zr](Cl)Cl

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.34
PTGS2 P35354 1/20 0.33
HTR1A P08908 1/20 0.32
HTR7 P34969 1/20 0.32
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
CYP11B2 P19099 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
SCHEMBL6889133 0.88 EDNRB (0.32)
SCHEMBL27463750 0.87 PTGS2 (0.33) PTGS2HTR1AHTR7SLC6A4SLC6A3
SCHEMBL3163967 0.87 BRD4 (0.33) HTR1AHTR7
SCHEMBL7934286 0.86 MAOA (0.30) SLC6A3
SCHEMBL4556848 0.85 KIF11 (0.33) CYP11B2
SCHEMBL8165787 0.83 BRD4 (0.35)
SCHEMBL6752680 0.83 HTR2C (0.35) HTR2CPTGS2HTR1AHTR7
SCHEMBL27464143 0.83 BRD4 (0.35)
SCHEMBL7598774 0.83 EDNRB (0.34)
SCHEMBL7203232 0.83 BRD4 (0.35)

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
CN-1138680-C Container for heating and sterilizing ������ѧ��ʽ���� 2004-02-18 CN disclosed
US-6583237-B1 Silyl-terminated olefin polymers; catalyst is transition metal cyclopentadiene compound, organoaluminum oxycompound, compounds that form an ion pair, organoaluminum compound, organosilicon compound, a dialkylzinc compound, and hydrogen MITSUI CHEMICALS, INC. (JP) 2003-06-24 US disclosed