SCHEMBL426783

SCHEMBL426783

COc1cc(C(=O)c2cc3ccccc3[nH]2)cc(OC)c1OC

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 6/20 0.74
PDGFRA P16234 6/20 0.74
FLT3 P36888 4/20 0.64
SMO Q99835 1/20 0.59
TUBB4A P04350 5/20 0.57
TUBB P07437 5/20 0.57
TUBA3C P0DPH7 5/20 0.57
TUBA1B P68363 5/20 0.57
TUBA4A P68366 5/20 0.57
TUBB4B P68371 5/20 0.57
TUBB3 Q13509 5/20 0.57
TUBB2A Q13885 5/20 0.57
TUBB8 Q3ZCM7 5/20 0.57
TUBA3E Q6PEY2 5/20 0.57
TUBA1A Q71U36 5/20 0.57
TUBA1C Q9BQE3 5/20 0.57
TUBB6 Q9BUF5 5/20 0.57
TUBB2B Q9BVA1 5/20 0.57
TUBB1 Q9H4B7 5/20 0.57
TP53 P04637 1/20 0.57

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
SCHEMBL424534 0.86 PDGFRB (0.59) PDGFRBPDGFRAFLT3SMOTUBB4A
SCHEMBL426498 0.84 PDGFRB (0.72) PDGFRBPDGFRAFLT3MEN1CYP1A2
SCHEMBL7065750 0.84 FLT3 (0.64) PDGFRBPDGFRAFLT3TUBB4ATUBB
SCHEMBL426735 0.84 FLT3 (0.60) PDGFRBPDGFRAFLT3TUBB4ATUBB
SCHEMBL430120 0.84 FLT3 (0.64) PDGFRBPDGFRAFLT3TUBB4ATUBB
SCHEMBL12677623 0.83 PDGFRB (0.58) PDGFRBPDGFRAFLT3SMOTUBB4A
SCHEMBL425103 0.83 FLT3 (0.60) PDGFRBPDGFRAFLT3TUBB4ATUBB
SCHEMBL429717 0.83 PDGFRB (0.60) PDGFRBPDGFRAFLT3TUBB4ATUBB
SCHEMBL426733 0.83 MEN1 (0.65) PDGFRBPDGFRAFLT3TUBB4ATUBB
SCHEMBL31705824 0.83 FLT3 (0.64) PDGFRBPDGFRAFLT3TUBB4ATUBB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104586842-B Anti-cancer activity indole derivative, synthesis method and uses thereof 温州大学 2017-04-12 CN claimed
US-20120022121-A1 INDOLES, DERIVATIVES AND ANALOGS THEREOF AND USES THEREFOR NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2012-01-26 US disclosed
US-20030158216-A1 2-acyl indole derivatives and their use as antitumor agents BAXTER ONCOLOGY GMBH 2003-08-21 US disclosed
US-20020091124-A1 2-acyl indole derivatives and their use as antitumor agents BECKERS THOMAS (DE) 2002-07-11 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-20120022121-A1 INDOLES, DERIVATIVES AND ANALOGS THEREOF AND USES THEREFOR TUBB, TUBB3, TUBB1 PDGFRB 2578/4885PDGFRA 2983/4885FLT3 3889/4885
US-20030158216-A1 2-acyl indole derivatives and their use as antitumor agents IDO1, IDO2, INMT PDGFRB 3807/4885PDGFRA 3147/4885FLT3 1953/4885
US-20020091124-A1 2-acyl indole derivatives and their use as antitumor agents IDO1, IDO2, INMT PDGFRB 3807/4885PDGFRA 3147/4885FLT3 1953/4885

“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.