SCHEMBL9425927

SCHEMBL9425927

O=C1OC(CBr)CN1c1cc(C(F)(F)F)cs1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 11/20 0.43
CALML3 P27482 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 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
SCHEMBL9425772 0.88 GRM2 (0.42) GRM2CALML3MAOAMAOB
SCHEMBL9425328 0.70 MAOA (0.41) GRM2CALML3MAOAMAOB
SCHEMBL10881242 0.68 MAOA (0.56) GRM2CALML3MAOAMAOB
SCHEMBL6607536 0.68 MAOA (0.56) GRM2CALML3MAOAMAOB
SCHEMBL11246885 0.68 MAOA (0.41) GRM2MAOAMAOB
SCHEMBL10879438 0.68 CALML3 (0.32) GRM2CALML3MAOAMAOB
SCHEMBL9846421 0.66 MAOA (0.54) GRM2CALML3MAOAMAOB
SCHEMBL9425917 0.66 GRM2 (0.44) GRM2
SCHEMBL2829551 0.65 GRM2 (0.69) GRM2
SCHEMBL9425346 0.65 LMNA (0.47) GRM2

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
JP-5194123-A None JP disclosed
US-5278179-A Fungicides BAYER AKTIENGESELLSCHAFT (DE) 1994-01-11 US disclosed
JP-H05194123-A SUBSTITUTED OXAZOLIDINONE-BASED PEST ORGANISM-CONTROLLING AGENT, NOVEL SUBSTITUTED OXAZOLIDINONE AND THEIR PRODUCTION AND USE BAYER AG 1993-08-03 JP disclosed