SCHEMBL4154766

SCHEMBL4154766

COc1ccc(-c2cc(C(=O)Nc3sc(C)c(C)c3C(N)=O)c3ccccc3n2)cc1OC

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 10/20 0.79
MAPT P10636 9/20 0.79
MEN1 O00255 9/20 0.79
LMNA P02545 4/20 0.79
ALDH1A1 P00352 7/20 0.77
HPGD P15428 5/20 0.77
MCL1 Q07820 1/20 0.77
GPR55 Q9Y2T6 2/20 0.76
CNR1 P21554 1/20 0.76
SMN1; SMN2 Q16637 5/20 0.70
HTT P42858 2/20 0.70
CYP3A4 P08684 2/20 0.67
CYP2C9 P11712 2/20 0.67
CYP2C19 P33261 2/20 0.67
CYP1A2 P05177 1/20 0.67
NPSR1 Q6W5P4 1/20 0.67
KDM4E B2RXH2 9/20 0.66
POLB P06746 2/20 0.66
RAB9A P51151 1/20 0.65
GAA P10253 1/20 0.61

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
SCHEMBL12273377 0.79 DHODH (0.80) KMT2AMAPTMEN1LMNAALDH1A1
SCHEMBL19219784 0.79 KDM4E (0.75) KMT2AMAPTMEN1LMNAALDH1A1
SCHEMBL28575804 0.78 KDM4E (0.74) KMT2AMAPTMEN1LMNAALDH1A1
SCHEMBL8614842 0.77 DHODH (0.72) KMT2AMAPTMEN1LMNAALDH1A1
SCHEMBL28914302 0.76 KDM4E (0.80) KMT2AMAPTMEN1LMNAALDH1A1
SCHEMBL42477 0.76 DHODH (0.81) KMT2AMAPTMEN1LMNAALDH1A1
SCHEMBL29788461 0.76 DHODH (0.81) KMT2AMAPTMEN1LMNAALDH1A1
SCHEMBL15506192 0.76 KDM4E (0.67) KMT2AMAPTMEN1LMNAALDH1A1
SCHEMBL28574876 0.76 MEN1 (0.75) KMT2AMAPTMEN1LMNAALDH1A1
SCHEMBL2631309 0.75 CA12 (0.71) KMT2AMAPTMEN1LMNAALDH1A1

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 6 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
EP-1802634-A2 THIOPHENS AND THEIR USE AS ANTI-TUMOR AGENTS Compass Pharmaceuticals LLC (US) 2007-07-04 EP claimed
WO-2006044826-A2 THIOPHENS AND THEIR USE AS ANTI-TUMOR AGENTS COMPASS PHARMACEUTICALS LLC (US) 2006-04-27 WO 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 KMT2A 3189/4885MAPT 1629/4885MEN1 46/4885

“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.