SCHEMBL6340645

SCHEMBL6340645

CCn1ccc2cc(S(=O)(=O)Nc3cc(OC)c(OC)c(OC)c3)ccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB4A P04350 3/20 0.56
TUBB P07437 3/20 0.56
TUBA3C P0DPH7 3/20 0.56
TUBA1B P68363 3/20 0.56
TUBA4A P68366 3/20 0.56
TUBB4B P68371 3/20 0.56
TUBB3 Q13509 3/20 0.56
TUBB2A Q13885 3/20 0.56
TUBB8 Q3ZCM7 3/20 0.56
TUBA3E Q6PEY2 3/20 0.56
TUBA1A Q71U36 3/20 0.56
TUBA1C Q9BQE3 3/20 0.56
TUBB6 Q9BUF5 3/20 0.56
TUBB2B Q9BVA1 3/20 0.56
TUBB1 Q9H4B7 3/20 0.56
HTT P42858 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
HTR6 P50406 2/20 0.48
LMNA P02545 3/20 0.46
THRB P10828 2/20 0.44

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
SCHEMBL26792 0.85 PKM (0.61) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL5423815 0.83 HTT (0.55) HTTSMN1; SMN2LMNATHRBTP53
SCHEMBL23148487 0.76 MAPT (0.61) HTTSMN1; SMN2LMNATHRBTP53
SCHEMBL6343382 0.75 PKM (0.61) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL28051135 0.75 HTT (0.52) HTTSMN1; SMN2HTR6LMNATHRB
SCHEMBL6341219 0.75 LMNA (0.79) HTTSMN1; SMN2LMNAMAPTPKM
SCHEMBL6048148 0.75 CYP19A1 (0.65) HTTSMN1; SMN2HTR6LMNAPKM
SCHEMBL28252795 0.73 HTT (0.50) HTTSMN1; SMN2LMNATHRBTP53
SCHEMBL28051139 0.72 MEN1 (0.51) HTTSMN1; SMN2HTR6LMNATHRB
SCHEMBL31687126 0.72 PKM (0.64) SMN1; SMN2HTR6LMNATP53MAPT

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050187246-A1 Cell proliferation inhibitors LI QUN (US) 2005-08-25 US claimed
EP-1181269-B1 CELL PROLIFERATION INHIBITORS ABBOTT LAB (US) 2004-02-25 EP claimed
US-20030096856-A1 Cell proliferation inhibitors ABBVIE INC. 2003-05-22 US claimed
US-6521658-B1 Cell proliferation inhibitors ABBOTT LABORATORIES 2003-02-18 US claimed
EP-1181269-A1 CELL PROLIFERATION INHIBITORS ABBOTT LABORATORIES (US) 2002-02-27 EP claimed
WO-2000073264-A1 CELL PROLIFERATION INHIBITORS ABBOTT LABORATORIES (US) 2000-12-07 WO claimed
US-20050187246-A1 Cell proliferation inhibitors LI QUN (US) 2005-08-25 US disclosed
US-6924304-B2 Cell proliferation inhibitors ABBOTT LABORATORIES (US) 2005-08-02 US disclosed
EP-1181269-B1 CELL PROLIFERATION INHIBITORS ABBOTT LAB (US) 2004-02-25 EP disclosed
US-20030096856-A1 Cell proliferation inhibitors ABBVIE INC. 2003-05-22 US disclosed
US-6521658-B1 Cell proliferation inhibitors ABBOTT LABORATORIES 2003-02-18 US disclosed
EP-1181269-A1 CELL PROLIFERATION INHIBITORS ABBOTT LABORATORIES (US) 2002-02-27 EP disclosed
WO-2000073264-A1 CELL PROLIFERATION INHIBITORS ABBOTT LABORATORIES (US) 2000-12-07 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 (2 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-20030096856-A1 Cell proliferation inhibitors MKI67, CCNI, CCNA1 TUBB4A 299/4885TUBB 317/4885TUBA3C 1548/4885
US-20050187246-A1 Cell proliferation inhibitors MKI67, CCNI, CCNC TUBB4A 259/4885TUBB 244/4885TUBA3C 1476/4885

“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.