SCHEMBL3920110

SCHEMBL3920110

COc1cc(C(=O)n2ccc3ccc(F)cc32)cc(OC)c1OC

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB1 Q9H4B7 7/20 0.64
TUBB4A P04350 5/20 0.47
TUBB P07437 5/20 0.47
TUBA3C P0DPH7 5/20 0.47
TUBA1B P68363 5/20 0.47
TUBA4A P68366 5/20 0.47
TUBB4B P68371 5/20 0.47
TUBB3 Q13509 5/20 0.47
TUBB2A Q13885 5/20 0.47
TUBB8 Q3ZCM7 5/20 0.47
TUBA3E Q6PEY2 5/20 0.47
TUBA1A Q71U36 5/20 0.47
TUBA1C Q9BQE3 5/20 0.47
TUBB6 Q9BUF5 5/20 0.47
TUBB2B Q9BVA1 5/20 0.47
PKM P14618 1/20 0.46
ELANE P08246 2/20 0.46
F2 P00734 1/20 0.46
PLAU P00749 1/20 0.46
KLKB1 P03952 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
SCHEMBL3916512 0.90 TUBB1 (0.75) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL3919425 0.84 TUBB1 (0.74) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL3916146 0.78 TUBB1 (0.77) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL3919337 0.78 TUBB1 (1.00) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL3915283 0.77 TUBB1 (0.63) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL3090187 0.76 TUBB1 (0.56) TUBB1L3MBTL1ALDH1A1
SCHEMBL3925860 0.74 TUBB1 (0.70) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL424408 0.73 TUBB4A (0.51) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL3919322 0.73 TUBB1 (0.69) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL3916932 0.73 TUBB1 (0.58) TUBB1TUBB4ATUBBTUBA3CTUBA1B

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-7632955-B2 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-12-15 US claimed
US-20050267108-A1 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2005-12-01 US claimed
US-20050267194-A1 Indole compounds NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2005-12-01 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 1/4885TUBB4A 7/4885TUBB 3/4885
US-20050267194-A1 Indole compounds TUBB1, TUBB, TUBB3 TUBB1 1/4885TUBB4A 7/4885TUBB 2/4885
US-20030195244-A1 Indole compounds NR2C2, NPSR1, HCRTR2 TUBB1 921/4885TUBB4A 1828/4885TUBB 829/4885

“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.