SCHEMBL10276232

SCHEMBL10276232

CCCN(CCC)S(=O)(=O)c1ccc(C2=CC(=O)N3N/C(C)=C\C=C(\c4ccc(F)cc4F)CC3N2)cc1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
GHSR Q92847 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL10275570 0.87 LMNA (0.35) LMNAMEN1KMT2AALDH1A1
SCHEMBL10276050 0.75 MEN1 (0.35) LMNAMEN1KMT2A
SCHEMBL10275520 0.73 MEN1 (0.34) LMNAMEN1KMT2A
SCHEMBL10275523 0.73 MEN1 (0.34) LMNAMEN1KMT2A
SCHEMBL10276061 0.72 LMNA (0.37) LMNAMEN1KMT2AALDH1A1
SCHEMBL10276267 0.69 KDM1A (0.34)
SCHEMBL10275810 0.69 LMNA (0.37) LMNAMEN1KMT2AALDH1A1
SCHEMBL10276064 0.68 LMNA (0.35) LMNAMEN1KMT2AALDH1A1
SCHEMBL10276404 0.66 KDM1A (0.35)
SCHEMBL10275579 0.64 MEN1 (0.37) LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120178915-A1 PYRIMIDINE DERIVATIVES AND ANALOGS, PREPARATION METHOD AND USE THEREOF XU LIFENG (US) 2012-07-12 US claimed

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-20120178915-A1 PYRIMIDINE DERIVATIVES AND ANALOGS, PREPARATION METHOD AND USE THEREOF TYMP, TYMS, ADORA3 LMNA 1504/4885MEN1 4229/4885KMT2A 4649/4885

“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.