SCHEMBL7790639

SCHEMBL7790639

Fc1ccc2c(c1)C[C]=C2

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 2/20 0.34
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
PDE3A Q14432 1/20 0.32

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
SCHEMBL387117 0.83 ADRA2A (0.35) HTR5A
SCHEMBL7794531 0.74 CYP1A2 (0.33) HTR5A
SCHEMBL7790645 0.74 AHR (0.37) HTR5A
SCHEMBL7795105 0.74 PNMT (0.34)
SCHEMBL9413877 0.73
SCHEMBL16617635 0.68 KCNH2 (0.32) HTR5ACA1CA2PDE3A
SCHEMBL208757 0.65 HTR2C (0.34)
SCHEMBL4167607 0.65 HTR5A (0.39) HTR5ACA1CA2PDE3A
SCHEMBL8343541 0.65 TRPA1 (0.34)
SCHEMBL20528826 0.65 TRPA1 (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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1155698-A1 ORGANOBORON COMPOUNDS EXHIBITING ANTICOCCIDIAL ACTIVITIES Nitto Kasei Co., Ltd. (JP) 2001-11-21 EP disclosed