SCHEMBL7991193

SCHEMBL7991193

c1[se]cc(C2CCCC2)c1C1CCCC1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDO2 P48775 2/20 0.37
CEL P19835 2/20 0.34
MAOA P21397 1/20 0.30
MAOB P27338 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
SCHEMBL7991677 0.97 TDO2 (0.39) TDO2CEL
SCHEMBL15243172 0.69 TDO2 (0.43) TDO2CEL
SCHEMBL779938 0.67 CHRNB4 (0.46) CEL
SCHEMBL2745291 0.65 TDO2 (0.37) TDO2CELMAOAMAOB
SCHEMBL42781 0.65 PTGDR2 (0.48) TDO2CEL
SCHEMBL1087151 0.64 KDM4E (0.49) TDO2
SCHEMBL22732970 0.63 DAO (0.50) TDO2CELMAOAMAOB
SCHEMBL143816 0.63 TDO2 (0.39) TDO2CEL
SCHEMBL11705406 0.62 ESR1 (0.41)
SCHEMBL9804702 0.62 ESR1 (0.41) TDO2

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
US-6197922-B1 ELECTROCHEMICAL POLYMERIZATION USING PALLADIUM COMPLEX CATALYST; STILLE AND SUZUKI REACTIONS BASF AKTIENGESELLSCHAFT (DE) 2001-03-06 US disclosed
EP-0902043-A2 Polyselenophenes, process for their preparation, and their use BASF AKTIENGESELLSCHAFT (DE) 1999-03-17 EP disclosed