SCHEMBL22801136

SCHEMBL22801136

COC(=O)c1ccc(N)c(CO[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.46
ALDH1A1 P00352 6/20 0.46
HPGD P15428 6/20 0.46
MAPT P10636 5/20 0.46
HSD17B10 Q99714 5/20 0.46
GAA P10253 3/20 0.46
GLA P06280 1/20 0.46
CASP1 P29466 1/20 0.46
CASP7 P55210 1/20 0.46
ATM Q13315 1/20 0.46
NQO2 P16083 1/20 0.42
LNPEP Q9UIQ6 4/20 0.41
PKM P14618 1/20 0.40
USP2 O75604 1/20 0.40
BACE1 P56817 1/20 0.39
HDAC1 Q13547 1/20 0.39
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA7 P43166 2/20 0.39

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
SCHEMBL4577651 0.90 KDM4E (0.49) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL30530843 0.84 MPO (0.41) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL16346874 0.84 NOTUM (0.45) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL25366639 0.84 MPO (0.41) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL2254005 0.82 MAPT (0.47) KDM4EALDH1A1MAPTNQO2BACE1
SCHEMBL28994694 0.82 NOTUM (0.48) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL1367394 0.82 DPP4 (0.41) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL17442848 0.80 CXCR2 (0.38) KDM4EALDH1A1HPGDMAPTHSD17B10
SCHEMBL18149568 0.79 POLB (0.40) KDM4EALDH1A1MAPTGAANQO2
SCHEMBL26814603 0.79 CYP1A2 (0.44) KDM4EALDH1A1HPGDMAPTHSD17B10

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
US-11655269-B2 Prodrug-type anticancer agent using cancer-specific enzymatic activity THE UNIVERSITY OF TOKYO (JP) 2023-05-23 US disclosed
US-11655269-B2 Prodrug-type anticancer agent using cancer-specific enzymatic activity THE UNIVERSITY OF TOKYO (JP) 2023-05-23 US disclosed
US-11655269-B2 Prodrug-type anticancer agent using cancer-specific enzymatic activity THE UNIVERSITY OF TOKYO (JP) 2023-05-23 US disclosed
EP-3763699-A1 PRODRUG-TYPE ANTICANCER AGENT USING CANCER-SPECIFIC ENZYMATIC ACTIVITY The University of Tokyo (JP) 2021-01-13 EP disclosed
US-20200399305-A1 PRODRUG-TYPE ANTICANCER AGENT USING CANCER-SPECIFIC ENZYMATIC ACTIVITY THE UNIVERSITY OF TOKYO (JP) 2020-12-24 US disclosed
US-20200399305-A1 PRODRUG-TYPE ANTICANCER AGENT USING CANCER-SPECIFIC ENZYMATIC ACTIVITY THE UNIVERSITY OF TOKYO (JP) 2020-12-24 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 (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-11655269-B2 Prodrug-type anticancer agent using cancer-specific enzymatic activity GUSB, NTPCR, FOLH1 KDM4E 2258/4885ALDH1A1 168/4885HPGD 574/4885
US-20200399305-A1 PRODRUG-TYPE ANTICANCER AGENT USING CANCER-SPECIFIC ENZYMATIC ACTIVITY GUSB, NTPCR, FOLH1 KDM4E 2258/4885ALDH1A1 168/4885HPGD 574/4885

“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.