SCHEMBL3919214

SCHEMBL3919214

COc1ccc2c(S(=O)(=O)c3cc(OC)c(OC)c(OC)c3)c[nH]c2c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB1 Q9H4B7 3/20 0.56
MAPT P10636 4/20 0.55
PDGFRB P09619 1/20 0.48
LMNA P02545 1/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TP53 P04637 1/20 0.47
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 1/20 0.47
TUBB4A P04350 1/20 0.46
TUBB P07437 1/20 0.46
TUBA3C P0DPH7 1/20 0.46
TUBA1B P68363 1/20 0.46
TUBA4A P68366 1/20 0.46
TUBB4B P68371 1/20 0.46
TUBB3 Q13509 1/20 0.46
TUBB2A Q13885 1/20 0.46
TUBB8 Q3ZCM7 1/20 0.46
TUBA3E Q6PEY2 1/20 0.46
TUBA1A Q71U36 1/20 0.46

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
SCHEMBL5520044 0.85 MAPT (0.69) TUBB1MAPTLMNAHTTSMN1; SMN2
SCHEMBL6109703 0.82 MAPT (0.81) MAPTLMNAHTTSMN1; SMN2TP53
SCHEMBL20355378 0.76 MAPT (0.55) TUBB1MAPTLMNAHTTSMN1; SMN2
SCHEMBL5784803 0.72 MAPT (0.78) MAPTLMNAHTTSMN1; SMN2TP53
SCHEMBL29441465 0.72 TUBB1 (1.00) TUBB1MAPTSMN1; SMN2TP53TUBB4A
SCHEMBL565514 0.72 TUBB1 (1.00) TUBB1MAPTSMN1; SMN2TP53TUBB4A
SCHEMBL28405115 0.71 MAPT (0.65) MAPTLMNAHTTSMN1; SMN2TP53
SCHEMBL3916978 0.71 TUBB1 (0.58) TUBB1PDGFRBTUBB4ATUBBTUBA3C
SCHEMBL3917834 0.71 TUBB4A (0.81) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL5095441 0.70 POLB (0.59) MAPTLMNAHTTSMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7528165-B2 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-05-05 US claimed
US-20050267108-A1 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2005-12-01 US claimed
US-6933316-B2 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2005-08-23 US claimed
EP-1506960-A1 Indole compounds as inhibitors of tubulin polymerisation for the treatment of angiogenesis-related disorders National Health Research Institutes (TW) 2005-02-16 EP claimed
US-20030195244-A1 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2003-10-16 US claimed
US-7632955-B2 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-12-15 US disclosed
US-7632955-B2 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-12-15 US disclosed
US-7632955-B2 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-12-15 US disclosed
US-7528165-B2 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-05-05 US disclosed
US-7528165-B2 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-05-05 US disclosed
US-7528165-B2 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-05-05 US disclosed
US-20050267108-A1 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2005-12-01 US disclosed
US-20050267194-A1 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2005-12-01 US disclosed
US-6933316-B2 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2005-08-23 US disclosed
EP-1506960-A1 Indole compounds as inhibitors of tubulin polymerisation for the treatment of angiogenesis-related disorders National Health Research Institutes (TW) 2005-02-16 EP disclosed
US-20030195244-A1 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2003-10-16 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 (3 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-20050267108-A1 Indole compounds TUBB1, TUBB3, TUBB TUBB1 1/4885MAPT 55/4885PDGFRB 115/4885
US-20050267194-A1 Indole compounds TUBB1, TUBB, TUBB3 TUBB1 1/4885MAPT 165/4885PDGFRB 98/4885
US-20030195244-A1 Indole compounds NR2C2, NPSR1, HCRTR2 TUBB1 921/4885MAPT 3276/4885PDGFRB 1674/4885

“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.