SCHEMBL20447442

SCHEMBL20447442

N[C@@H](CO)c1ccc(Cl)cn1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 2/20 0.39
ADRA2B P18089 2/20 0.39
ADRA2C P18825 2/20 0.39
PLAU P00749 1/20 0.39
MAOB P27338 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.35
S1PR3 Q99500 7/20 0.35
S1PR2 O95136 3/20 0.35
S1PR4 O95977 3/20 0.35
FDPS P14324 1/20 0.34
FDFT1 P37268 1/20 0.34
S1PR1 P21453 4/20 0.34

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
SCHEMBL20447446 1.00 ADRA2A (0.39) ADRA2AADRA2BADRA2CPLAUMAOB
SCHEMBL29872347 1.00 ADRA2A (0.39) ADRA2AADRA2BADRA2CPLAUMAOB
SCHEMBL20472734 0.85 MAOB (0.38) ADRA2AADRA2BADRA2CPLAUMAOB
SCHEMBL17622922 0.82 MAOB (0.38) ADRA2AADRA2BADRA2CPLAUMAOB
SCHEMBL1534271 0.81 MAOB (0.40) ADRA2AADRA2BADRA2CPLAUMAOB
SCHEMBL24501187 0.78 PYGL (0.46) ADRA2AADRA2BADRA2CPLAUL3MBTL1
SCHEMBL30640205 0.78 PYGL (0.46) ADRA2AADRA2BADRA2CPLAUL3MBTL1
SCHEMBL29108209 0.78 PYGL (0.46) ADRA2AADRA2BADRA2CPLAUL3MBTL1
SCHEMBL29108562 0.78 PYGL (0.46) ADRA2AADRA2BADRA2CPLAUL3MBTL1
SCHEMBL30640220 0.78 PYGL (0.46) ADRA2AADRA2BADRA2CPLAUL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3356344-B1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION HAVING ANTICANCER ACTIVITY ASTEX THERAPEUTICS LTD (GB) 2022-11-16 EP disclosed
CN-108473464-B Isoindolinone inhibitors of MDM2-P53 interaction with anti-cancer activity 阿斯泰克斯治疗有限公司 2022-08-23 CN disclosed
US-20220106287-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION HAVING ANTICANCER ACTIVITY ASTEX THERAPEUTICS LIMITED (GB) 2022-04-07 US disclosed
US-11261171-B1 Isoindolinone inhibitors of the MDM2-P53 interaction having anticancer activity ASTEX THERAPEUTICS LIMITED (GB) 2022-03-01 US disclosed
US-20190055215-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION HAVING ANTICANCER ACTIVITY ASTEX THERAPEUTICS LIMITED (GB) 2019-02-21 US disclosed
US-20190055215-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION HAVING ANTICANCER ACTIVITY ASTEX THERAPEUTICS LIMITED (GB) 2019-02-21 US disclosed
EP-3356344-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION HAVING ANTICANCER ACTIVITY Astex Therapeutics Ltd (GB) 2018-08-08 EP 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 (3 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-20220106287-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION HAVING ANTICANCER ACTIVITY TP53, MDM2, TP53BP1 ADRA2A 3963/4885ADRA2B 3931/4885ADRA2C 3919/4885
US-20190055215-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION HAVING ANTICANCER ACTIVITY TP53, MDM2, TP53BP1 ADRA2A 3963/4885ADRA2B 3931/4885ADRA2C 3919/4885
US-11261171-B1 Isoindolinone inhibitors of the MDM2-P53 interaction having anticancer activity TP53, MDM2, TP53BP1 ADRA2A 3963/4885ADRA2B 3931/4885ADRA2C 3919/4885

“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.