SCHEMBL22990885

SCHEMBL22990885

Cc1ncc(OCC(=O)OC(C)(C)C)cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.41
KDM4E B2RXH2 3/20 0.40
ALDH1A1 P00352 3/20 0.40
PSEN1 P49768 2/20 0.40
PSEN2 P49810 2/20 0.40
APH1B Q8WW43 2/20 0.40
NCSTN Q92542 2/20 0.40
APH1A Q96BI3 2/20 0.40
PSENEN Q9NZ42 2/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
GAA P10253 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HPGD P15428 3/20 0.38
MAPT P10636 2/20 0.38
POLB P06746 2/20 0.38
LMNA P02545 2/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPSR1 Q6W5P4 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
SCHEMBL25659622 0.85 PTPN1 (0.41) PTPN1KDM4EALDH1A1PSEN1PSEN2
SCHEMBL19281442 0.85 PTPN1 (0.41) PTPN1KDM4EALDH1A1PSEN1PSEN2
SCHEMBL22617041 0.83 PTPN1 (0.40) PTPN1KDM4EALDH1A1PSEN1PSEN2
SCHEMBL25659620 0.82 PTPN1 (0.42) PTPN1KDM4EALDH1A1PSEN1PSEN2
SCHEMBL25659631 0.82 PTPN1 (0.39) PTPN1KDM4EALDH1A1PSEN1PSEN2
SCHEMBL12147577 0.82 PTPN1 (0.44) PTPN1KDM4EALDH1A1PSEN1PSEN2
SCHEMBL25659619 0.81 PTPN1 (0.39) PTPN1KDM4EALDH1A1PSEN1PSEN2
SCHEMBL26425582 0.79 PSEN1 (0.38) PTPN1KDM4EALDH1A1PSEN1PSEN2
SCHEMBL30188377 0.78 PTPN1 (0.44) PTPN1KDM4EALDH1A1PSEN1PSEN2
SCHEMBL23348672 0.78 PTPN1 (0.44) PTPN1KDM4EALDH1A1PSEN1PSEN2

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
EP-3819305-A1 AMIDE COMPOUND HAVING BET PROTEOLYSIS-INDUCING ACTION AND MEDICINAL APPLICATION THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2021-05-12 EP disclosed
US-20210047315-A1 CYCLIC COMPOUND HAVING DOPAMINE D3 RECEPTOR ANTAGONISTIC EFFECT SHIONOGI & CO., LTD. (JP) 2021-02-18 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 (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-20210047315-A1 CYCLIC COMPOUND HAVING DOPAMINE D3 RECEPTOR ANTAGONISTIC EFFECT DRD3, DRD2, DRD1 PTPN1 633/4885KDM4E 3733/4885ALDH1A1 2235/4885

“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.