SCHEMBL9778706

SCHEMBL9778706

Clc1cccc(COc2ccc(C3SCCS3)cc2)c1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.58
MAOA P21397 5/20 0.58
RXRA P19793 1/20 0.53
RXRB P28702 1/20 0.53
RXRG P48443 1/20 0.53
S1PR1 P21453 1/20 0.50
S1PR5 Q9H228 1/20 0.50
DHFR P00374 1/20 0.49
ALOX5 P09917 1/20 0.48
GRM5 P41594 1/20 0.47

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
SCHEMBL9778874 0.95 MAOB (0.56) MAOBMAOARXRARXRBRXRG
SCHEMBL9778648 0.92 MAOB (0.57) MAOBMAOARXRARXRBRXRG
SCHEMBL9778755 0.83 MAOB (0.53) MAOBMAOAGRM5
SCHEMBL9778824 0.82 MAOB (0.54) MAOBMAOADHFR
SCHEMBL9778553 0.82 MAOB (0.59) MAOB
SCHEMBL9778622 0.82 MAOB (0.59) MAOBMAOAALOX5
SCHEMBL9778910 0.82 LMNA (0.49) MAOB
SCHEMBL9778737 0.81 KCNH2 (0.54) MAOBMAOAGRM5
SCHEMBL9778545 0.80 SLC6A4 (0.42) MAOBMAOA
SCHEMBL9778858 0.79 NR4A2 (0.55) S1PR1S1PR5

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-5063197-A Aromatic compound MITSUBISHI PAPER MILLS LIMITED (JP) 1991-11-05 US disclosed