SCHEMBL21851077

SCHEMBL21851077

CN1C(=O)C2(CCN(C(=O)C3CC3)CC2)c2c1cnc1ccc(-c3ccc(F)nc3)cc21

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 2/20 0.42
▸ ATM Q13315 2/20 0.42
▸ ALDH1A1 P00352 13/20 0.42
▸ MELK Q14680 2/20 0.40
▸ CHRM1 P11229 2/20 0.39
▸ IRAK4 Q9NWZ3 1/20 0.38

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
SCHEMBL21851073 0.90 ATM (0.44) PRKDCATMALDH1A1
SCHEMBL21851207 0.88 ATM (0.47) PRKDCATMALDH1A1MELK
SCHEMBL21851096 0.86 ATM (0.44) PRKDCATMCHRM1IRAK4
SCHEMBL21851037 0.85 ATM (0.42) PRKDCATMMELK
SCHEMBL21851136 0.85 PRKDC (0.44) PRKDCATM
SCHEMBL21851019 0.84 ATM (0.45) PRKDCATMCHRM1
SCHEMBL23615865 0.84 ATM (0.44) PRKDCATM
SCHEMBL21851161 0.84 ATM (0.46) PRKDCATMCHRM1
SCHEMBL21851072 0.83 ALDH1A1 (0.40) ALDH1A1
SCHEMBL21851056 0.83 ATM (0.46) PRKDCATMIRAK4

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-3845532-B1 QUINOLINO-PYRROLIDIN-2-ONE DERIVATIVE AND APPLICATION THEREOF MEDSHINE DISCOVERY INC (CN) 2022-12-21 — — EP disclosed
US-11230549-B2 Quinolino-pyrrolidin-2-one derivative and application thereof MEDSHINE DISCOVERY INC. (CN) 2022-01-25 — — US disclosed
US-20210380599-A1 QUINOLINO-PYRROLIDIN-2-ONE DERIVATIVE AND APPLICATION THEREOF MEDSHINE DISCOVERY INC. (CN) 2021-12-09 — — US disclosed
EP-3845532-A1 QUINOLINO-PYRROLIDIN-2-ONE DERIVATIVE AND APPLICATION THEREOF Medshine Discovery Inc. (CN) 2021-07-07 — — EP disclosed
WO-2020063855-A1 QUINOLINO-PYRROLIDIN-2-ONE DERIVATIVE AND APPLICATION THEREOF 南京明德新药研发有限公司 2020-04-02 — — WO 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 (2 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-11230549-B2 Quinolino-pyrrolidin-2-one derivative and application thereof ATM, CHEK2, CHEK1 PRKDC 227/4885ATM 1/4885ALDH1A1 2781/4885
US-20210380599-A1 QUINOLINO-PYRROLIDIN-2-ONE DERIVATIVE AND APPLICATION THEREOF ATM, CHEK2, CHEK1 PRKDC 227/4885ATM 1/4885ALDH1A1 2781/4885

“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.

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