SCHEMBL9130357

SCHEMBL9130357

CCc1cc(C)cc(S)n1

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 11/20 0.57
NOS3 P29474 6/20 0.57
NOS1 P29475 7/20 0.39
ESR1 P03372 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
SCHEMBL6464978 0.83 NOS2 (0.70) NOS2NOS3NOS1ESR1
SCHEMBL9126124 0.77 NOS3 (0.38) NOS2NOS3NOS1ESR1
SCHEMBL16405300 0.77
SCHEMBL7116565 0.76 NOS2 (0.61) NOS2NOS3NOS1
SCHEMBL23280308 0.73 NOS2 (0.57) NOS2NOS3NOS1
SCHEMBL13827864 0.73 NOS2 (0.57) NOS2NOS3NOS1ESR1
SCHEMBL18611531 0.73 NOS2 (0.57) NOS2NOS3NOS1
SCHEMBL20072591 0.73 NOS2 (0.57) NOS2NOS3NOS1
SCHEMBL7049604 0.73 NOS2 (1.00) NOS2NOS3NOS1
SCHEMBL8430579 0.70

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-5399488-A Kidneys NITTO BOSEKI CO., LTD. (JP) 1995-03-21 US disclosed