SCHEMBL25176751

SCHEMBL25176751

COC(=O)c1ccc2cc(CCNC(=O)OC(C)(C)C)ccc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 1/20 0.47
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
BRD4 O60885 1/20 0.45
CES2 O00748 1/20 0.45
CCNC P24863 2/20 0.44
CDK8 P49336 2/20 0.44
NAMPT P43490 1/20 0.44
MAPT P10636 4/20 0.43
GLA P06280 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
HIF1A Q16665 1/20 0.42
MGLL Q99685 1/20 0.42
DHODH Q02127 2/20 0.42
PTPN11 Q06124 1/20 0.42
KMT2A Q03164 2/20 0.41
CYP4F2 P78329 1/20 0.41

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
SCHEMBL30369597 1.00 NQO2 (0.47) NQO2CA1CA2BRD4CES2
SCHEMBL5544971 0.87 NAMPT (0.46) BRD4NAMPTALDH1A1PTPN11
SCHEMBL1936202 0.87 MGLL (0.55) NQO2CA1CA2NAMPTMAPT
SCHEMBL31539425 0.85 CYP4F2 (0.59) NQO2CA2NAMPTMAPTKDM4E
SCHEMBL2996602 0.85 CYP4F2 (0.59) NQO2CA2NAMPTMAPTKDM4E
SCHEMBL6197159 0.84 NAMPT (0.46) BRD4NAMPTALDH1A1CTSBCTSS
SCHEMBL4465651 0.83 MGLL (0.51) CA1CA2NAMPTMAPTGLA
SCHEMBL21090363 0.81 CYP4F2 (0.49) NQO2CA1CA2MAPTKMT2A
SCHEMBL13900839 0.81 NAMPT (0.53) NQO2CA1CA2CES2NAMPT
SCHEMBL8591195 0.81 MAPT (0.56) CA1CA2NAMPTMAPTGLA

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-20250127906-A1 SMALL-MOLECULE DEGRADERS OF CDK8 AND CDK19 UNIVERSITY OF SOUTH CAROLINA 2025-04-24 US disclosed
WO-2023081452-A1 SMALL-MOLECULE DEGRADERS OF CDK8 AND CDK19 UNIVERSITY OF SOUTH CAROLINA (US) 2023-05-11 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-20250127906-A1 SMALL-MOLECULE DEGRADERS OF CDK8 AND CDK19 CDK8, CDK9, CDK18 NQO2 3059/4885CA1 3651/4885CA2 3851/4885

“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.