SCHEMBL12603866

SCHEMBL12603866

Cn1nc(N2CCC(Oc3cccc(C(F)(F)F)c3)CC2)c(=O)[nH]c1=O

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.48
▸ KMT2A Q03164 1/20 0.48
▸ TP53 P04637 1/20 0.47
▸ SLC6A2 P23975 1/20 0.45
▸ SLC6A4 P31645 1/20 0.45
▸ SLC6A3 Q01959 1/20 0.45
▸ SCN10A Q9Y5Y9 1/20 0.43
▸ SCD O00767 3/20 0.43
▸ EPHX2 P34913 1/20 0.42
▸ PDE9A O76083 1/20 0.41
▸ HTR2C P28335 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ ABHD6 Q9BV23 1/20 0.39
▸ NR3C1 P04150 1/20 0.39
▸ ACACB O00763 1/20 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
SCHEMBL5544461 0.75 MEN1 (0.61) MEN1KMT2ATP53SLC6A2SLC6A4
SCHEMBL13536307 0.74 SCD (0.60) SCD
SCHEMBL1923047 0.73 SCD (0.62) SCDPDE9AHTR2C
SCHEMBL12603864 0.72 SCD (0.52) SCD
SCHEMBL23600164 0.72 SCD (0.47) MEN1KMT2ATP53SLC6A2SLC6A4
SCHEMBL31312429 0.71 MEN1 (0.50) MEN1KMT2ATP53SLC6A2SLC6A4
SCHEMBL20858622 0.71 SLC6A2 (0.69) MEN1KMT2ATP53SLC6A2SLC6A4
SCHEMBL13855665 0.71 MEN1 (0.59) MEN1KMT2ATP53SLC6A2SLC6A4
SCHEMBL12603863 0.71 SCD (0.48) SCD
SCHEMBL1782603 0.70 FPR2 (0.52) SCDEPHX2

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-20110118266-A1 DERIVATIVES OF TRIAZINES AND URACILS, THEIR PREPARATION AND THEIR APPLICATION IN HUMAN THERAPEUTICS PIERRE FABRE MEDICAMENT (FR) 2011-05-19 — — US disclosed
US-20110118266-A1 DERIVATIVES OF TRIAZINES AND URACILS, THEIR PREPARATION AND THEIR APPLICATION IN HUMAN THERAPEUTICS PIERRE FABRE MEDICAMENT (FR) 2011-05-19 — — 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 (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-20110118266-A1 DERIVATIVES OF TRIAZINES AND URACILS, THEIR PREPARATION AND THEIR APPLICATION IN HUMAN THERAPEUTICS UNG, TYMS, UMPS MEN1 1468/4885KMT2A 3052/4885TP53 57/4885

“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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