SCHEMBL869557

SCHEMBL869557

Cc1ccoc1C(=O)Nc1cccc(-c2cncc(C(=O)N=[S@](=O)(CCCN3CCN(CCOCCO)CC3)c3ccccc3)c2)c1

nearest known ligand 0.69

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.69
PDGFRB P09619 9/20 0.52
EIF2AK2 P19525 1/20 0.42

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
SCHEMBL835030 0.91 KDR (0.83) KDRPDGFRBEIF2AK2
SCHEMBL848188 0.91 KDR (0.83) KDRPDGFRBEIF2AK2
SCHEMBL10182233 0.89 KDR (0.54) KDRPDGFRB
SCHEMBL10182337 0.88 KDR (0.63) KDRPDGFRBEIF2AK2
SCHEMBL10182051 0.86 KDR (0.51) KDRPDGFRBEIF2AK2
SCHEMBL10182158 0.86 KDR (0.65) KDRPDGFRBEIF2AK2
SCHEMBL834629 0.85 KDR (0.75) KDRPDGFRBEIF2AK2
SCHEMBL848398 0.85 KDR (0.75) KDRPDGFRBEIF2AK2
SCHEMBL869778 0.85 KDR (0.55) KDRPDGFRBEIF2AK2
SCHEMBL10183847 0.84 KDR (0.54) KDRPDGFRBEIF2AK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8383825-B2 Kinase inhibitors ALLERGAN, INC. (US) 2013-02-26 US disclosed
US-20120207810-A1 Kinase Inhibitors SPADA LON T (US) 2012-08-16 US disclosed
US-8143410-B2 Kinase inhibitors ALLERGAN, INC. (US) 2012-03-27 US disclosed
US-20110263611-A1 Kinase Inhibitors ALLERGAN, INC. 2011-10-27 US disclosed
US-20100278897-A1 INTRAOCULAR BIOACTIVE AGENT DELIVERY SYSTEM WITH MOLECULAR PARTITIONING SYSTEM ALLERGAN, INC. (US) 2010-11-04 US disclosed
US-20090196906-A1 Kinase inhibitors ALLERGAN, INC. 2009-08-06 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-20110263611-A1 Kinase Inhibitors PTK2, MAP3K6, MAP3K20 KDR 51/4885PDGFRB 368/4885EIF2AK2 882/4885
US-20120207810-A1 Kinase Inhibitors PTK2, MAP3K6, MAP3K20 KDR 51/4885PDGFRB 368/4885EIF2AK2 882/4885
US-20100278897-A1 INTRAOCULAR BIOACTIVE AGENT DELIVERY SYSTEM WITH MOLECULAR PARTITIONING SYSTEM MMP1, IGFBP2, BMP2 KDR 570/4885PDGFRB 1150/4885EIF2AK2 1387/4885
US-20090196906-A1 Kinase inhibitors PTK2, MAP3K6, MAP3K20 KDR 51/4885PDGFRB 368/4885EIF2AK2 882/4885

“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.