SCHEMBL4262136

SCHEMBL4262136

COCOc1c(OC)cc(/C=C/c2ccc(C#N)cc2)cc1OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB1 Q9H4B7 16/20 0.52
TUBB4A P04350 10/20 0.52
TUBB P07437 10/20 0.52
TUBA3C P0DPH7 10/20 0.52
TUBA1B P68363 10/20 0.52
TUBA4A P68366 10/20 0.52
TUBB4B P68371 10/20 0.52
TUBB3 Q13509 10/20 0.52
TUBB2A Q13885 10/20 0.52
TUBB8 Q3ZCM7 10/20 0.52
TUBA3E Q6PEY2 10/20 0.52
TUBA1A Q71U36 10/20 0.52
TUBA1C Q9BQE3 10/20 0.52
TUBB6 Q9BUF5 10/20 0.52
TUBB2B Q9BVA1 10/20 0.52
CYP19A1 P11511 1/20 0.47
NQO2 P16083 1/20 0.47
CYP1A1 P04798 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP1B1 Q16678 1/20 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
SCHEMBL4262138 1.00 TUBB1 (0.52) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL4261037 0.86 FDPS (0.55) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL4261032 0.86 FDPS (0.55) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL17332395 0.85 TUBB1 (0.65) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL17332394 0.85 TUBB1 (0.65) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL4258541 0.83 TUBB1 (0.43) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL4258542 0.83 TUBB1 (0.43) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL4258651 0.81 ESR1 (0.49) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL4258655 0.81 ESR1 (0.49) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL4254401 0.80 PPARG (0.58)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7629375-B2 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods JOHNSON & JOHNSON CONSUMER COMPANIES, INC. (US) 2009-12-08 US disclosed
US-20060178356-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods GALILEO PHARMACEUTICALS, INC. 2006-08-10 US disclosed
US-20050142155-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods JOHNSON & JOHNSON CONSUMER INC. 2005-06-30 US disclosed
US-20050113416-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods GALILEO PHARMACEUTICALS, INC. 2005-05-26 US disclosed
US-20030073712-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods JOHNSON & JOHNSON CONSUMER COMPANIES, INC. 2003-04-17 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 (4 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-20050142155-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 TUBB1 1806/4885TUBB4A 2280/4885TUBB 2088/4885
US-20030073712-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 TUBB1 1806/4885TUBB4A 2280/4885TUBB 2088/4885
US-20050113416-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 TUBB1 1806/4885TUBB4A 2280/4885TUBB 2088/4885
US-20060178356-A1 Cytoprotective compounds, pharmaceutical and cosmetic formulations, and methods HSF1, HMOX1, NQO1 TUBB1 1806/4885TUBB4A 2280/4885TUBB 2088/4885

“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.