SCHEMBL7335272

SCHEMBL7335272

C=C[C@H]1CCCC[C@@H]1CBr

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL7295327 1.00 TSHR (0.30) TSHR
SCHEMBL7295356 1.00 TSHR (0.30) TSHR
SCHEMBL7295329 1.00 TSHR (0.30) TSHR
SCHEMBL7332966 0.76 TDP1 (0.38) TSHR
SCHEMBL7332971 0.76 TDP1 (0.38) TSHR
SCHEMBL14639737 0.76 TDP1 (0.38) TSHR
SCHEMBL9501178 0.76 CHRNB2 (0.40)
SCHEMBL7336141 0.76 TDP1 (0.38) TSHR
SCHEMBL28439943 0.73 MEN1 (0.34)
SCHEMBL11960899 0.73 SIGMAR1 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5583248-A Amino acid derivatives having antiviral activity HOFFMANN-LA ROCHE INC. (US) 1996-12-10 US disclosed
EP-0512343-B1 Amino acid derivatives and their use as anti-viral agents HOFFMANN LA ROCHE (CH) 1995-08-02 EP disclosed
US-5430041-A Amino acid derivatives having antiviral activity HOFFMANN-LA ROCHE INC. (US) 1995-07-04 US disclosed