SCHEMBL22864682

SCHEMBL22864682

CCOC(=O)C1CN(Cc2ccccc2)CC12CCCC2

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.49
ATM Q13315 1/20 0.49
ALDH1A1 P00352 4/20 0.48
SIGMAR1 Q99720 2/20 0.48
KDM4E B2RXH2 2/20 0.45
GAA P10253 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
MEN1 O00255 2/20 0.44
LMNA P02545 2/20 0.44
KMT2A Q03164 2/20 0.44
USP30 Q70CQ3 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
CCR8 P51685 1/20 0.43

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
SCHEMBL16053764 0.99 L3MBTL1 (0.48) L3MBTL1ATMALDH1A1SIGMAR1KDM4E
SCHEMBL30751751 0.98 L3MBTL1 (0.49) L3MBTL1ATMALDH1A1SIGMAR1KDM4E
SCHEMBL4509900 0.95 ALDH1A1 (0.50) L3MBTL1ATMALDH1A1SIGMAR1KDM4E
SCHEMBL24729554 0.90 ALDH1A1 (0.42) L3MBTL1ATMALDH1A1SIGMAR1KDM4E
SCHEMBL30751712 0.90 SIGMAR1 (0.48) L3MBTL1ATMALDH1A1SIGMAR1CYP3A4
SCHEMBL27329178 0.87 ALDH1A1 (0.47) L3MBTL1ATMALDH1A1SIGMAR1KDM4E
SCHEMBL6356789 0.87 CYP2D6 (0.46) ALDH1A1KDM4ECYP3A4CYP2D6MEN1
SCHEMBL21685887 0.85 SIGMAR1 (0.47) L3MBTL1ATMALDH1A1SIGMAR1KDM4E
SCHEMBL4105884 0.84 L3MBTL1 (0.49) L3MBTL1ATMALDH1A1SIGMAR1KDM4E
SCHEMBL9566495 0.84 KDM4E (0.53) L3MBTL1ATMALDH1A1SIGMAR1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220389037-A1 HPK1 INHIBITORS AND USES THEREOF REGOR PHARMACEUTICALS, INC. 2022-12-08 US disclosed
WO-2021000935-A1 HPK1 INHIBITORS AND USES THEREOF QILU REGOR THERAPEUTICS INC. (CN) 2021-01-07 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 (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-20220389037-A1 HPK1 INHIBITORS AND USES THEREOF HIPK1, SIK1, PGK1 L3MBTL1 2199/4885ATM 924/4885ALDH1A1 3740/4885

“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.