SCHEMBL6802279

SCHEMBL6802279

CCOS(=O)(=O)[O-].CC[N+]1=C(C)C(C)(C)c2c1ccc1c(S(=O)(=O)O)cc(S(=O)(=O)O)cc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 4/20 0.42
MEN1 O00255 2/20 0.34
MAPT P10636 2/20 0.34
KMT2A Q03164 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
LMNA P02545 1/20 0.34
THRB P10828 1/20 0.34
HTT P42858 1/20 0.34
RECQL P46063 1/20 0.34
HDAC3 O15379 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC10 Q969S8 1/20 0.31
HDAC11 Q96DB2 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HDAC9 Q9UKV0 1/20 0.31
HDAC5 Q9UQL6 1/20 0.31

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
SCHEMBL14823545 0.90 FOLH1 (0.43) FOLH1MEN1MAPTKMT2ATDP1
SCHEMBL7750174 0.83 MAPT (0.41) FOLH1MEN1MAPTKMT2ATDP1
SCHEMBL14823554 0.80 TDP1 (0.40) FOLH1MEN1MAPTKMT2ATDP1
SCHEMBL17988752 0.80 MEN1 (0.45) FOLH1MEN1MAPTKMT2ATDP1
SCHEMBL14883322 0.80 MEN1 (0.42) FOLH1MEN1MAPTKMT2ATDP1
SCHEMBL25790183 0.79 FOLH1 (0.40) FOLH1MEN1MAPTKMT2ATDP1
SCHEMBL14347674 0.78 MEN1 (0.42) FOLH1MEN1MAPTKMT2ATDP1
SCHEMBL15095683 0.77 FOLH1 (0.44) FOLH1MEN1MAPTKMT2ATDP1
SCHEMBL1370729 0.77 MAPT (0.43) FOLH1MEN1MAPTKMT2ATDP1
SCHEMBL16195355 0.76 MEN1 (0.39) FOLH1MEN1MAPTKMT2ATDP1

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
US-6734310-B2 A CYANINE DYE, WITH A COMBINATION OF SULPHOARYL GROUPS, ALKYL SUBSTITUENTS IN THE MESO POSITION OF THE METHINE CHAIN AND AT LEAST ONE REACTIVE GROUP WHICH PERMITS BINDING TO BIOMOLECULES. FEW CHEMICALS GMBH (DE) 2004-05-11 US disclosed
EP-1272566-B1 FLUORESCENT MARKER FEW CHEMICALS GMBH (DE) 2003-12-17 EP disclosed
US-20030135058-A1 Flurescent marker FEW CHEMICALS GMBH (DE) 2003-07-17 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-20030135058-A1 Flurescent marker MYADM, CCL2, CD14 FOLH1 1182/4885MEN1 1576/4885MAPT 3427/4885

“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.