SCHEMBL20154729

SCHEMBL20154729

CC(C)(C)OC(=O)NCCCNc1nc(Cl)ncc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
STK17B O94768 1/20 1.00
STK17A Q9UEE5 1/20 1.00
BRD4 O60885 16/20 0.46
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
LATS1 O95835 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
SCHEMBL23409124 0.88 STK17B (0.79) STK17BSTK17ABRD4MEN1GAA
SCHEMBL3868126 0.88 STK17B (0.79) STK17BSTK17ABRD4MEN1GAA
SCHEMBL13518095 0.87 STK17B (0.77) STK17BSTK17ABRD4MEN1GAA
SCHEMBL12651273 0.87 STK17B (0.77) STK17BSTK17ABRD4MEN1GAA
SCHEMBL24070647 0.86 STK17B (0.75) STK17BSTK17ABRD4TDP1
SCHEMBL3387315 0.84 STK17A (0.72) STK17BSTK17ABRD4
SCHEMBL29802555 0.84 STK17A (0.72) STK17BSTK17ABRD4MEN1GAA
SCHEMBL11909214 0.81 STK17B (0.67) STK17BSTK17ABRD4MEN1GAA
SCHEMBL4549833 0.81 STK17B (0.67) STK17BSTK17ABRD4MEN1GAA
SCHEMBL2723366 0.81 STK17B (0.67) STK17BSTK17ABRD4MEN1GAA

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-3539951-B1 NOVEL PYRIMIDINE COMPOUND, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING CANCER AND INFLAMMATORY DISEASES KOREA RES INST CHEMICAL TECH (KR) 2020-10-07 EP disclosed
US-10647686-B2 Substituted pyrimidines for preventing or treating cancer and inflammatory diseases KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2020-05-12 US disclosed
US-20190284143-A1 NOVEL PYRIMIDINE COMPOUND, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING CANCER AND INFLAMMATORY DISEASES KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2019-09-19 US disclosed
EP-3539951-A1 NOVEL PYRIMIDINE COMPOUND, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING CANCER AND INFLAMMATORY DISEASES Korea Research Institute of Chemical Technology (KR) 2019-09-18 EP disclosed
WO-2018088749-A1 NOVEL PYRIMIDINE COMPOUND, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING CANCER AND INFLAMMATORY DISEASES 한국화학연구원 2018-05-17 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-20190284143-A1 NOVEL PYRIMIDINE COMPOUND, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS ACTIVE INGREDIENT FOR PREVENTING OR TREATING CANCER AND INFLAMMATORY DISEASES DTYMK, TGFB1, DCK STK17B 1114/4885STK17A 1127/4885BRD4 3238/4885
US-10647686-B2 Substituted pyrimidines for preventing or treating cancer and inflammatory diseases TGFBR1, TGFBR2, TGFB1 STK17B 977/4885STK17A 885/4885BRD4 206/4885

“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.