SCHEMBL21851161

SCHEMBL21851161

CCN1CCC2(CC1)C(=O)N(C)c1cnc3ccc(-c4ccc(F)nc4)cc3c12

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 5/20 0.46
▸ PRKDC P78527 3/20 0.46
▸ CHRM1 P11229 2/20 0.37
▸ OPRM1 P35372 2/20 0.36
▸ OPRK1 P41145 2/20 0.36
▸ OPRL1 P41146 2/20 0.36
▸ DYRK1A Q13627 2/20 0.35
▸ GSK3B P49841 1/20 0.35
▸ MTOR P42345 2/20 0.35
▸ HTT P42858 1/20 0.34
▸ ATR Q13535 1/20 0.33

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
SCHEMBL21851019 0.91 ATM (0.45) ATMPRKDCCHRM1OPRM1OPRK1
SCHEMBL21851149 0.90 PRKDC (0.48) ATMPRKDCCHRM1OPRM1OPRK1
SCHEMBL23615865 0.87 ATM (0.44) ATMPRKDCMTORATR
SCHEMBL21851056 0.86 ATM (0.46) ATMPRKDCDYRK1AGSK3BMTOR
SCHEMBL21851073 0.86 ATM (0.44) ATMPRKDCDYRK1AGSK3BMTOR
SCHEMBL21851096 0.86 ATM (0.44) ATMPRKDCCHRM1OPRM1OPRK1
SCHEMBL21851167 0.85 ATM (0.46) ATMPRKDCMTORATR
SCHEMBL21851207 0.84 ATM (0.47) ATMPRKDCDYRK1AGSK3BMTOR
SCHEMBL21851077 0.84 PRKDC (0.42) ATMPRKDCCHRM1
SCHEMBL24221491 0.82 ATM (0.45) ATMPRKDCMTORATR

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 ATM 1/4885PRKDC 227/4885CHRM1 3441/4885
US-20210380599-A1 QUINOLINO-PYRROLIDIN-2-ONE DERIVATIVE AND APPLICATION THEREOF ATM, CHEK2, CHEK1 ATM 1/4885PRKDC 227/4885CHRM1 3441/4885

“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.

Send feedback