SCHEMBL22201794

SCHEMBL22201794

CCCCC1CC2CCC(C1)C(CCc1cccc(F)c1F)C2

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 1/20 0.32
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
SLC6A4 P31645 1/20 0.31
EPHX2 P34913 1/20 0.31
ADORA2A P29274 1/20 0.31

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
SCHEMBL22201793 0.82 ADORA2A (0.32) HTR2AHTR2CSLC6A4EPHX2ADORA2A
SCHEMBL8983100 0.77 MAOA (0.38) HTR2AHTR2C
SCHEMBL8983091 0.77 MAOA (0.38) HTR2AHTR2C
SCHEMBL9406269 0.75 MAOA (0.40) HTR2AHTR2C
SCHEMBL9406263 0.75 MAOA (0.40) HTR2AHTR2C
SCHEMBL22201802 0.74 MEN1 (0.35)
SCHEMBL4801585 0.72 MAOA (0.40) OPRL1HTR2AHTR2C
SCHEMBL7736441 0.72 RIPK1 (0.36) OPRL1SLC6A4
SCHEMBL7736449 0.72 RIPK1 (0.36) OPRL1SLC6A4
SCHEMBL7736446 0.72 RIPK1 (0.36) OPRL1SLC6A4

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
US-20200216670-A1 THERMOSETTING SILICON-CONTAINING COMPOUND, COMPOSITION FOR FORMING A SILICON-CONTAINING FILM, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-07-09 US disclosed