SCHEMBL17537229

SCHEMBL17537229

CN[C@@H](C(C)=O)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
LMNA P02545 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
TDP1 Q9NUW8 1/20 0.44
PDE4A P27815 1/20 0.43
USP2 O75604 1/20 0.41
SLCO1B1 Q9Y6L6 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.37
MAPT P10636 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
SCHEMBL875592 0.83 PDE4A (0.54) KDM4ELMNAL3MBTL1TDP1PDE4A
SCHEMBL13010838 0.82 KDM4E (0.47) KDM4ELMNAL3MBTL1TDP1PDE4A
SCHEMBL13010836 0.82 KDM4E (0.47) KDM4ELMNAL3MBTL1TDP1PDE4A
SCHEMBL9235255 0.82 LMNA (0.44) KDM4ELMNAL3MBTL1TDP1PDE4A
Mannitol SCHEMBL8472459 0.77 LMNA (0.69) KDM4ELMNAL3MBTL1TDP1PDE4A
Mannitol SCHEMBL11031577 0.77 LMNA (0.69) KDM4ELMNAL3MBTL1TDP1PDE4A
Mannitol SCHEMBL26606265 0.77 LMNA (0.69) KDM4ELMNAL3MBTL1TDP1PDE4A
Mannitol SCHEMBL7927609 0.77 LMNA (0.69) KDM4ELMNAL3MBTL1TDP1PDE4A
Mannitol SCHEMBL3017327 0.77 LMNA (0.69) KDM4ELMNAL3MBTL1TDP1PDE4A
Mannitol SCHEMBL21903806 0.74 LMNA (0.65) KDM4ELMNAL3MBTL1TDP1PDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2995604-B1 PHENOL DERIVATIVE AND PREPARATION METHOD AND USE IN MEDICINE THEREOF SICHUAN HAISCO PHARMACEUTICAL CO LTD (CN) 2019-07-10 EP disclosed
US-9517988-B2 Phenol derivative and preparation method and use in medicine thereof SICHUAN HAISCO PHARMACEUTICAL CO., LTD. (CN) 2016-12-13 US disclosed
EP-2995604-A1 PHENOL DERIVATIVE AND PREPARATION METHOD AND USE IN MEDICINE THEREOF Sichuan Haisco Pharmaceutical Co., Ltd. (CN) 2016-03-16 EP disclosed
US-20160060197-A1 PHENOL DERIVATIVE AND PREPARATION METHOD AND USE IN MEDICINE THEREOF SICHUAN HAISCO PHARMACEUTICAL CO., LTD. (CN) 2016-03-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160060197-A1 PHENOL DERIVATIVE AND PREPARATION METHOD AND USE IN MEDICINE THEREOF CYP2D6, CYP2B6, CYP2A6 KDM4E 1414/4885LMNA 2674/4885L3MBTL1 4412/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.