SCHEMBL5016504

SCHEMBL5016504

CCC(F)CNc1cccc2c(S(=O)(=O)O)cccc12

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.42
TTR P02766 1/20 0.42
KCNA5 P22460 1/20 0.35
IDO1 P14902 1/20 0.35
SNCA P37840 2/20 0.34
NSD2 O96028 1/20 0.34
HTR6 P50406 2/20 0.34
EDNRA P25101 1/20 0.34
CHAT P28329 1/20 0.34
ATIC P31939 1/20 0.34
SUMO2 P61956 1/20 0.34
SUMO1 P63165 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP2 Q9HC62 1/20 0.34
SLC6A9 P48067 1/20 0.34

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
SCHEMBL5024402 0.88 CYP1A2 (0.43) CYP1A2TTRKCNA5IDO1SNCA
SCHEMBL9626477 0.81 TTR (0.50) CYP1A2TTRIDO1SNCANSD2
SCHEMBL13223261 0.76 MAPT (0.47) CYP1A2TTRIDO1EDNRASLC6A9
SCHEMBL5016478 0.76 CNR1 (0.52) CYP1A2TTRIDO1
SCHEMBL5022978 0.76 CNR1 (0.49) CYP1A2TTRIDO1
SCHEMBL14159082 0.76 CYP1A2 (0.51) CYP1A2TTR
SCHEMBL12221061 0.74 TTR (0.46) CYP1A2TTRIDO1SNCANSD2
SCHEMBL7757566 0.74 TTR (0.56) CYP1A2TTRIDO1SNCANSD2
SCHEMBL14012469 0.74 CYP1A2 (0.46) CYP1A2TTRIDO1SNCANSD2
SCHEMBL12041809 0.73 TTR (0.45) CYP1A2TTRIDO1SNCANSD2

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-7365223-B2 Method for selective targeting of apoptotic cells and small molecule ligands used thereof NST NEUROSURVIVAL TECHNOLOGIES LTD (IL) 2008-04-29 US disclosed
US-20060160901-A1 Method for selective targeting of apoptotic cells and small molecule ligands used thereof APOSENSE LTD. (IL) 2006-07-20 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-20060160901-A1 Method for selective targeting of apoptotic cells and small molecule ligands used thereof BAD, BAX, CASP3 CYP1A2 4638/4885TTR 4380/4885KCNA5 4071/4885

“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.