SCHEMBL4137069

SCHEMBL4137069

COc1cccc(-n2c(C(F)(F)F)nc3sc4c(c3c2=O)CCCCC4)c1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.58
POLB P06746 3/20 0.58
ALDH1A1 P00352 6/20 0.57
KMT2A Q03164 4/20 0.57
MEN1 O00255 3/20 0.57
MAPT P10636 5/20 0.54
SMN1; SMN2 Q16637 4/20 0.54
KDM4E B2RXH2 3/20 0.54
HPGD P15428 2/20 0.54
GAA P10253 2/20 0.54
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
THRB P10828 1/20 0.54
BRD4 O60885 1/20 0.50
NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL4139711 0.87 MAPT (0.51) LMNAPOLBALDH1A1KMT2AMEN1
SCHEMBL4154510 0.87 BRD4 (0.52) LMNAPOLBALDH1A1KMT2AMEN1
SCHEMBL4147430 0.87 MAPT (0.51) LMNAPOLBALDH1A1KMT2AMEN1
SCHEMBL4141378 0.87 MAPT (0.51) LMNAPOLBALDH1A1KMT2AMEN1
SCHEMBL4134647 0.86 MAPT (0.52) LMNAPOLBALDH1A1KMT2AMEN1
SCHEMBL4153731 0.86 MAPT (0.52) LMNAPOLBALDH1A1KMT2AMEN1
SCHEMBL4139738 0.86 MAPT (0.51) LMNAPOLBALDH1A1KMT2AMEN1
SCHEMBL4146568 0.86 MAPT (0.64) LMNAPOLBALDH1A1KMT2AMEN1
SCHEMBL4147354 0.85 ALDH1A1 (0.47) LMNAPOLBALDH1A1KMT2AMEN1
SCHEMBL4140834 0.84 ALDH1A1 (0.47) LMNAPOLBALDH1A1KMT2AMEN1

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 4 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
EP-1802634-A2 THIOPHENS AND THEIR USE AS ANTI-TUMOR AGENTS Compass Pharmaceuticals LLC (US) 2007-07-04 EP disclosed
WO-2006044826-A2 THIOPHENS AND THEIR USE AS ANTI-TUMOR AGENTS COMPASS PHARMACEUTICALS LLC (US) 2006-04-27 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-20090143411-A1 Thiophens and Their Use as Anti-Tumor Agents TP53, BRDT, VHL LMNA 3634/4885POLB 2342/4885ALDH1A1 1202/4885

“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.