SCHEMBL18502919

SCHEMBL18502919

CC(C)(C)OC(=O)N1CCN(c2nc(=O)cn[nH]2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CKS1B P61024 2/20 0.46
▸ SKP1 P63208 2/20 0.46
▸ SKP2 Q13309 2/20 0.46
▸ KCNH2 Q12809 1/20 0.45
▸ NR1H2 P55055 1/20 0.44
▸ MAPT P10636 3/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ ACACB O00763 2/20 0.43
▸ ACHE P22303 1/20 0.43
▸ GPR119 Q8TDV5 2/20 0.42
▸ MAP4K4 O95819 1/20 0.42
▸ NAMPT P43490 1/20 0.42
▸ DDB1 Q16531 1/20 0.41
▸ CRBN Q96SW2 1/20 0.41
▸ PTPN11 Q06124 1/20 0.41
▸ CHRM2 P08172 1/20 0.41
▸ CHRM4 P08173 1/20 0.41
▸ CHRM1 P11229 1/20 0.41
▸ CHRM3 P20309 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
SCHEMBL20231972 0.77 MAPT (0.49) CKS1BSKP1SKP2KCNH2NR1H2
SCHEMBL16825695 0.76 MAP4K4 (0.46) CKS1BSKP1SKP2KCNH2MAPT
SCHEMBL11946229 0.76 POLB (0.61) CKS1BSKP1SKP2NR1H2ALDH1A1
SCHEMBL20817915 0.76 TRPC5 (0.50) CKS1BSKP1SKP2KCNH2NR1H2
SCHEMBL20831279 0.75 CCNC (0.43) CKS1BSKP1SKP2NR1H2MAPT
SCHEMBL20818351 0.75 KCNH2 (0.44) CKS1BSKP1SKP2KCNH2NR1H2
SCHEMBL21796931 0.73 ACACB (0.49) CKS1BSKP1SKP2KCNH2MAPT
SCHEMBL30729125 0.73 CYP3A4 (0.64) CKS1BSKP1SKP2MAPTALDH1A1
SCHEMBL3956511 0.73 CYP3A4 (0.52) CKS1BSKP1SKP2MAPTALDH1A1
SCHEMBL30776677 0.73 CYP3A4 (0.52) CKS1BSKP1SKP2MAPTALDH1A1

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
US-10329263-B2 Disubstituted 1, 2, 4-triazine compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2019-06-25 — — US disclosed
US-10029993-B2 Disubstituted 1, 2, 4-triazine compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2018-07-24 — — US disclosed
US-10029993-B2 Disubstituted 1, 2, 4-triazine compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2018-07-24 — — US disclosed
US-20170044115-A1 NOVEL DISUBSTITUTED 1, 2, 4-TRIAZINE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-02-16 — — US disclosed
US-20170044115-A1 NOVEL DISUBSTITUTED 1, 2, 4-TRIAZINE COMPOUND MITSUBISHI TANABE PHARMA CORPORATION (JP) 2017-02-16 — — 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 (3 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-10329263-B2 Disubstituted 1, 2, 4-triazine compound NR3C2, REN, NR5A1 CKS1B 207/4885SKP1 721/4885SKP2 1911/4885
US-20170044115-A1 NOVEL DISUBSTITUTED 1, 2, 4-TRIAZINE COMPOUND NR3C2, REN, CYP21A2 CKS1B 180/4885SKP1 881/4885SKP2 1969/4885
US-10029993-B2 Disubstituted 1, 2, 4-triazine compound NR3C2, REN, NR5A1 CKS1B 207/4885SKP1 721/4885SKP2 1911/4885

“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.

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