SCHEMBL4148996

SCHEMBL4148996

O=C(c1ccc(Cl)cc1)c1c(NC(=O)C(F)(F)F)sc2c1CCCCC2

nearest known ligand 0.76

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ANO1 Q5XXA6 13/20 0.76
ANO2 Q9NQ90 2/20 0.64
MAPT P10636 5/20 0.62
TP53 P04637 4/20 0.62
BLM P54132 1/20 0.62
SMN1; SMN2 Q16637 3/20 0.61
MEN1 O00255 1/20 0.60
TNF P01375 1/20 0.60
KMT2A Q03164 1/20 0.60
NOD1 Q9Y239 1/20 0.60
TDP1 Q9NUW8 2/20 0.59
ALDH1A1 P00352 1/20 0.59
LMNA P02545 1/20 0.59
RCE1 Q9Y256 1/20 0.59
FLT3 P36888 1/20 0.59

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
SCHEMBL4140504 0.86 ANO1 (0.74) ANO1ANO2MAPTTP53BLM
SCHEMBL4134799 0.86 ANO1 (1.00) ANO1ANO2MAPTTP53BLM
SCHEMBL4151223 0.86 ANO1 (1.00) ANO1ANO2MAPTTP53BLM
SCHEMBL4147246 0.85 ANO1 (0.98) ANO1ANO2MAPTTP53BLM
SCHEMBL4147685 0.81 ANO1 (0.64) ANO1ANO2MAPTTP53BLM
SCHEMBL4140828 0.81 ANO1 (0.70) ANO1ANO2MAPTTP53SMN1; SMN2
SCHEMBL4132190 0.81 ANO1 (0.70) ANO1ANO2MAPTTP53SMN1; SMN2
SCHEMBL4134763 0.80 ANO1 (0.74) ANO1ANO2MAPTTP53BLM
SCHEMBL4132192 0.80 ANO1 (0.76) ANO1ANO2MAPTTP53SMN1; SMN2
SCHEMBL20541812 0.79 ANO1 (0.69) ANO1ANO2MAPTTP53BLM

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-20090143411-A1 Thiophens and Their Use as Anti-Tumor Agents COMPASS PHARMACEUTICALS LLC (US) 2009-06-04 US claimed
US-20090143411-A1 Thiophens and Their Use as Anti-Tumor Agents COMPASS PHARMACEUTICALS LLC (US) 2009-06-04 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-20090143411-A1 Thiophens and Their Use as Anti-Tumor Agents TP53, BRDT, VHL ANO1 3854/4885ANO2 3897/4885MAPT 1629/4885

“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.