SCHEMBL8729752

SCHEMBL8729752

[CH2]COCCCCCCCCCCCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
SIGMAR1 Q99720 7/20 0.48
IDO1 P14902 1/20 0.48
MAOA P21397 1/20 0.47
MAPT P10636 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
MAOB P27338 1/20 0.45
NAAA Q02083 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL299681 1.00 TDP1 (0.54) TDP1L3MBTL1SIGMAR1IDO1MAOA
SCHEMBL511327 1.00 TDP1 (0.54) TDP1L3MBTL1SIGMAR1IDO1MAOA
SCHEMBL9021195 1.00 TDP1 (0.54) TDP1L3MBTL1SIGMAR1IDO1MAOA
SCHEMBL8496055 1.00 TDP1 (0.54) TDP1L3MBTL1SIGMAR1IDO1MAOA
SCHEMBL299485 0.98 L3MBTL1 (0.51) TDP1L3MBTL1SIGMAR1IDO1MAOA
SCHEMBL294856 0.92 IDO1 (0.57) TDP1L3MBTL1SIGMAR1IDO1MAOA
SCHEMBL11247567 0.88 IDO1 (0.53) TDP1L3MBTL1SIGMAR1IDO1MEN1
SCHEMBL7449055 0.87 TDP1 (0.61) TDP1L3MBTL1SIGMAR1IDO1MAOA
SCHEMBL8048487 0.87 TDP1 (0.61) TDP1L3MBTL1SIGMAR1IDO1MAOA
SCHEMBL7449325 0.87 TDP1 (0.61) TDP1L3MBTL1SIGMAR1IDO1MAOA

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
WO-1998019535-A1 DISINFECTANT COMPOSITION, PARTICULARLY FOR THE PREVENTION OF DERMATITIS INDUCED BY DIAPERS, AND METHOD FOR ITS USE GEYMONAT S.P.A. (IT) 1998-05-14 WO disclosed