SCHEMBL7605035

SCHEMBL7605035

CCC1c2ccccc2-c2c(C)cccc21.Cc1cccc2c1C([Zr])c1ccccc1-2

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.37
PDE10A Q9Y233 1/20 0.35
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
HTR7 P34969 1/20 0.30
HTR2B P41595 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
SCHEMBL27335604 0.85 HTR2A (0.44) HTR2APDE10ACA1CA2HTR7
SCHEMBL3981626 0.79 HTR2A (0.44) HTR2APDE10ACA1CA2HTR7
SCHEMBL8857191 0.79 HTR2A (0.42) HTR2ACA1CA2HTR7HTR2B
Hydrochloric Acid SCHEMBL6557592 0.77 HTR2A (0.36) HTR2APDE10ACA1CA2
Hydrochloric Acid SCHEMBL8917342 0.76 HTR2A (0.36) HTR2APDE10AHTR7
Hydrochloric Acid SCHEMBL5366067 0.76 HTR2A (0.40) HTR2ACA1CA2HTR7HTR2B
SCHEMBL7141056 0.76 MYC (0.39) HTR2ACA1CA2HTR7HTR2B
SCHEMBL27379567 0.74 HTR2A (0.38) HTR2ACA1CA2HTR7HTR2B
SCHEMBL17208391 0.74 PBRM1 (0.40) HTR2ACA1CA2HTR2B
Hydrochloric Acid SCHEMBL8917252 0.73 HTR2A (0.42) HTR2APDE10ACA1CA2HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0524624-B1 Use of organometallic flurorenyl compounds. PHILLIPS PETROLEUM CO (US) 2002-05-15 EP claimed