SCHEMBL9764170

SCHEMBL9764170

CCCOC(=O)CC1CO1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MIF P14174 3/20 0.47
PPM1B O75688 1/20 0.41
PTPN1 P18031 1/20 0.41
PPP1CC P36873 1/20 0.41
ALDH1A1 P00352 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
PRKCA P17252 2/20 0.37
MAPT P10636 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL9463642 0.89 MIF (0.49) MIFALDH1A1SMN1; SMN2PRKCATDP1
SCHEMBL3070093 0.89 MIF (0.49) MIFALDH1A1SMN1; SMN2PRKCATDP1
SCHEMBL3069917 0.85 NAAA (0.56) MIFALDH1A1PRKCATDP1
SCHEMBL3062283 0.83
SCHEMBL7804568 0.83
SCHEMBL7803427 0.83
SCHEMBL28263792 0.82 MGAM (0.44) MIFALDH1A1
SCHEMBL19287024 0.81 DGKA (0.41) MIFPPM1BPTPN1PPP1CCALDH1A1
SCHEMBL14477600 0.81 ALDH1A1 (0.41) ALDH1A1TDP1
SCHEMBL15878938 0.80 ALDH1A1 (0.39) MIFALDH1A1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3124618-B1 METHOD FOR SEPARATING AND CONCENTRATING TARGET SUBSTANCE USING NOVEL CATIONIC GRAFT POLYMER NITTO BOSEKI CO LTD (JP) 2019-05-15 EP disclosed
US-5032590-A Substituted hydroxylamines BAYER AKTIENGESELLSCHAFT (DE) 1991-07-16 US disclosed
US-4968681-A Substituted hydroxylamines BAYER AKTIENGESELLSCHAFT (DE) 1990-11-06 US disclosed
WO-1990011075-A1 ANGIOGENIC MONOBUTYRIN AND ITS ANALOGS DANA FARBER CANCER INSTITUTE (US) 1990-10-04 WO disclosed
CN-1033991-A SUBSTITUTED HYDROXYLAMINES BAYER AG (DE) 1989-07-19 CN disclosed