SCHEMBL9876138

SCHEMBL9876138

CCOCCOc1ccc(C(C)C)cc2cc3cscc3c1-2

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 2/20 0.34
BCHE P06276 2/20 0.32
ACHE P22303 2/20 0.32
TSHR P16473 1/20 0.31
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL9825553 0.90 DCK (0.33)
SCHEMBL9826194 0.88 CASR (0.38) BCHEACHEHTTSMN1; SMN2
SCHEMBL9875961 0.86 CASR (0.35) HTT
SCHEMBL9824893 0.83 NCF1 (0.43) NCF1BCHEACHESMN1; SMN2
SCHEMBL9876132 0.81
SCHEMBL9825549 0.80
SCHEMBL9825004 0.80 HDAC4 (0.36) SMN1; SMN2
SCHEMBL9826044 0.79 NCF1 (0.32) NCF1BCHEACHEHTTSMN1; SMN2
SCHEMBL9824980 0.77 CASR (0.39) HTTSMN1; SMN2
SCHEMBL9825546 0.74

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-5037575-A Photostability MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) 1991-08-06 US disclosed