SCHEMBL20741307

SCHEMBL20741307

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

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 2/20 0.35
ADRA2B P18089 2/20 0.35
ADRA2C P18825 2/20 0.35
PLAU P00749 1/20 0.35
S1PR3 Q99500 9/20 0.32
S1PR4 O95977 5/20 0.32
S1PR2 O95136 4/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
S1PR1 P21453 3/20 0.32
BRD4 O60885 1/20 0.32
NFE2L2 Q16236 1/20 0.31
FDPS P14324 1/20 0.31
FDFT1 P37268 1/20 0.31
KDR P35968 1/20 0.30
MAOB P27338 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
SCHEMBL20741308 1.00 ADRA2A (0.35) ADRA2AADRA2BADRA2CPLAUS1PR3
SCHEMBL10670778 0.80 ADRA2A (0.33) ADRA2AADRA2BADRA2CPLAUS1PR3
SCHEMBL9625236 0.77 ESR1 (0.42)
SCHEMBL1853872 0.77 ADRA2A (0.35) ADRA2AADRA2BADRA2CPLAUS1PR3
SCHEMBL10321351 0.74 ADRB2 (0.39) ADRA2AADRA2BADRA2CPLAUS1PR3
SCHEMBL10321352 0.74 ADRB2 (0.39) ADRA2AADRA2BADRA2CPLAUS1PR3
SCHEMBL2563540 0.74 ALDH1A1 (0.35) L3MBTL1FDPS
SCHEMBL15332425 0.74 ALDH1A1 (0.35) L3MBTL1FDPS
SCHEMBL4337075 0.74 ADRB2 (0.46) ADRA2AADRA2BADRA2CPLAUS1PR3
SCHEMBL4323766 0.74 ADRB2 (0.46) ADRA2AADRA2BADRA2CPLAUS1PR3

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 6 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

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.