SCHEMBL934549

SCHEMBL934549

CCNS(=O)(=O)c1cccc(OBOc2cccc(S(=O)(=O)NCC)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.49
MEP1B Q16820 1/20 0.48
LMNA P02545 2/20 0.46
MAPT P10636 1/20 0.46
ALOX15 P16050 1/20 0.46
TSHR P16473 1/20 0.46
MAPK1 P28482 1/20 0.46
KMT2A Q03164 1/20 0.45
BRD4 O60885 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
VCAM1 P19320 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
CYP2C9 P11712 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL1822202 0.84 MEP1B (0.65) ALDH1A1MEP1BLMNAMAPTALOX15
SCHEMBL15303538 0.82 L3MBTL1 (0.50) MEP1BLMNAL3MBTL1FFAR4KEAP1
SCHEMBL4041550 0.80 ALDH1A1 (0.59) ALDH1A1LMNAMAPTALOX15TSHR
SCHEMBL645132 0.80 PSIP1 (0.48) ALDH1A1MEP1BMAPTKMT2ABRD4
SCHEMBL8478768 0.78 MAPT (0.61) ALDH1A1MEP1BLMNAMAPTKMT2A
SCHEMBL934211 0.76 DDB1 (0.44) FFAR4KEAP1NFE2L2SMN1; SMN2
SCHEMBL9568500 0.76 MEP1B (0.49) ALDH1A1MEP1BLMNAMAPTALOX15
SCHEMBL31404044 0.75 KMT2A (0.77) ALDH1A1KMT2A
SCHEMBL350324 0.75 KMT2A (0.77) ALDH1A1KMT2A
SCHEMBL3246202 0.75 MEP1B (0.48) ALDH1A1MEP1BLMNAMAPTALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2454243-A2 TETRAZOLE DERIVATIVES Merck Serono SA (CH) 2012-05-23 EP disclosed
US-20120115869-A1 TETRAZOLE DERIVATIVES MERCK SERONO S.A. (CH) 2012-05-10 US disclosed
WO-2011006935-A2 TETRAZOLE DERIVATIVES MERCK SERONO S.A. (CH) 2011-01-20 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 (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-20120115869-A1 TETRAZOLE DERIVATIVES TSLP, IL5, CMA1 ALDH1A1 184/4885MEP1B 1535/4885LMNA 4204/4885

“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.