SCHEMBL14949475

SCHEMBL14949475

CC(C)(C)OC(=O)NC(=O)NC(=O)OC(C)(C)C

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA7 P43166 2/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
GAA P10253 1/20 0.39
MAPK1 P28482 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
CA12 O43570 2/20 0.38
CA14 Q9ULX7 2/20 0.38
APLNR P35414 1/20 0.38
EPHX1 P07099 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
SCHEMBL4960633 0.89 GAA (0.38) DGAT1TDP1NFKB1NFKB2RELA
SCHEMBL101218 0.88 DGAT1 (0.46) DGAT1TDP1NFKB1NFKB2RELA
SCHEMBL12246341 0.87 CA1 (0.39) DGAT1TDP1NFKB1NFKB2RELA
SCHEMBL1522412 0.86 DGAT1 (0.44) DGAT1TDP1NFKB1NFKB2RELA
SCHEMBL6272856 0.86 DGAT1 (0.44) DGAT1TDP1NFKB1NFKB2RELA
Potassium SCHEMBL29554503 0.86 DGAT1 (0.44) DGAT1TDP1NFKB1NFKB2RELA
SCHEMBL22063661 0.82 CTSK (0.44) TDP1CA1CA2CA7MEN1
SCHEMBL3755352 0.81 DGAT1 (0.41) DGAT1TDP1NFKB1NFKB2RELA
SCHEMBL3509747 0.81 DGAT1 (0.46) DGAT1TDP1NFKB1NFKB2RELA
SCHEMBL3951511 0.81 APLNR (0.41) DGAT1TDP1NFKB1NFKB2RELA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025101904-A1 NOREPINEPHRINE TRANSPORTER-TARGETED PRODRUGS FOR CANCER THERAPY THE CHILDREN'S HOSPITAL OF PHILADELPHIA (US) 2025-05-15 WO disclosed
CN-116234806-A Cyclic 2-amino-3-cyanothiophenes and derivatives thereof for the treatment of cancer 勃林格殷格翰国际有限公司 2023-06-06 CN disclosed
CN-116034106-A Cyclic 2-amino-3-cyanothiophenes and derivatives for the treatment of cancer 勃林格殷格翰国际有限公司 2023-04-28 CN disclosed
CN-114901652-A Substituted saturated and unsaturated N-heterocyclic carboxamides and related compounds for the treatment of medical disorders 比亚尔R&D投资股份公司 2022-08-12 CN disclosed
US-11352343-B2 Urea derivatives and uses thereof KALA PHARMACEUTICALS, INC. (US) 2022-06-07 US disclosed
US-8957216-B2 Heterocyclic compounds useful for kinase inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. (US) 2015-02-17 US disclosed
US-8957216-B2 Heterocyclic compounds useful for kinase inhibition AMITECH THERAPEUTIC SOLUTIONS, INC. (US) 2015-02-17 US disclosed
WO-2014138484-A1 PERFLUORINATED CYCLOPROPYL FUSED 1,3-OXAZIN-2-AMINE COMPOUNDS AS BETA-SECRETASE INHIBITORS AND METHODS OF USE AMGEN INC. (US) 2014-09-12 WO disclosed
US-20130123284-A1 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION AMITECH THERAPEUTIC SOLUTIONS INC (US) 2013-05-16 US disclosed
US-20130123284-A1 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION AMITECH THERAPEUTIC SOLUTIONS INC (US) 2013-05-16 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-20130123284-A1 HETEROCYCLIC COMPOUNDS USEFUL FOR KINASE INHIBITION MAP4K2, MAP3K20, MAP3K19 DGAT1 1917/4885TDP1 1948/4885NFKB1 2084/4885
US-11352343-B2 Urea derivatives and uses thereof UACA, RB1, FLT1 DGAT1 4627/4885TDP1 3546/4885NFKB1 264/4885

“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.