SCHEMBL1364248

SCHEMBL1364248

O=C(c1cc(O)ccc1Cl)c1c[nH]c2ncc(-c3cccs3)cc12

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PAK1 Q13153 12/20 0.46
CDK8 P49336 1/20 0.46
PKN1 Q16512 2/20 0.44
PAK4 O96013 1/20 0.44
AXL P30530 4/20 0.41
AAK1 Q2M2I8 1/20 0.40
CHEK1 O14757 1/20 0.39

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
SCHEMBL857637 0.92 PAK1 (0.46) PAK1CDK8PKN1PAK4
SCHEMBL12147046 0.88 PAK1 (0.49) PAK1CDK8PKN1PAK4AXL
SCHEMBL856944 0.88 CDK8 (0.46) PAK1CDK8AXLAAK1CHEK1
SCHEMBL414660 0.85 AAK1 (0.49) PAK1CDK8AXLAAK1CHEK1
SCHEMBL857771 0.83 AAK1 (0.48) PAK1CDK8PAK4AXLAAK1
SCHEMBL858125 0.83 CDK8 (0.52) PAK1CDK8PKN1PAK4AXL
SCHEMBL857018 0.82 PAK1 (0.50) PAK1CDK8PKN1AXLAAK1
SCHEMBL858503 0.82 CDK8 (0.48) PAK1CDK8AXL
SCHEMBL442522 0.80 CDK8 (0.46) PAK1CDK8PKN1AXLAAK1
SCHEMBL856681 0.80 CDK8 (0.46) PAK1CDK8AXLAAK1CHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1696920-B1 COMPOUNDS AND METHODS FOR DEVELOPMENT OF RET MODULATORS PLEXXIKON INC (US) 2014-10-29 EP disclosed
US-8067434-B2 Compounds and methods for development of Ret modulators PLEXXIKON INC. (US) 2011-11-29 US disclosed
US-8067434-B2 Compounds and methods for development of Ret modulators PLEXXIKON INC. (US) 2011-11-29 US disclosed
US-8067434-B2 Compounds and methods for development of Ret modulators PLEXXIKON INC. (US) 2011-11-29 US disclosed
US-20100324065-A1 Compounds and methods for development of Ret Modulators PLEXXIKON INC 2010-12-23 US disclosed
US-20100324065-A1 Compounds and methods for development of Ret Modulators PLEXXIKON INC 2010-12-23 US disclosed
US-20100324065-A1 Compounds and methods for development of Ret Modulators PLEXXIKON INC 2010-12-23 US disclosed
US-7504509-B2 Compounds and methods for development of Ret modulators PLEXXIKON, INC. (US) 2009-03-17 US disclosed
US-7504509-B2 Compounds and methods for development of Ret modulators PLEXXIKON, INC. (US) 2009-03-17 US disclosed
US-7504509-B2 Compounds and methods for development of Ret modulators PLEXXIKON, INC. (US) 2009-03-17 US disclosed
US-20070066641-A1 Compounds and methods for development of RET modulators PLEXXIKON, INC. 2007-03-22 US disclosed
US-20070066641-A1 Compounds and methods for development of RET modulators PLEXXIKON, INC. 2007-03-22 US disclosed
US-20070049615-A1 Compounds and methods for development of Ret modulators PLEXXIKON, INC. 2007-03-01 US disclosed
US-20070049615-A1 Compounds and methods for development of Ret modulators PLEXXIKON, INC. 2007-03-01 US disclosed
US-20070049615-A1 Compounds and methods for development of Ret modulators PLEXXIKON, INC. 2007-03-01 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-20100324065-A1 Compounds and methods for development of Ret Modulators RET, GFRA3, GFRA1 PAK1 298/4885CDK8 1633/4885PKN1 2626/4885
US-20070066641-A1 Compounds and methods for development of RET modulators RET, FGFR1, FGFR3 PAK1 269/4885CDK8 854/4885PKN1 2569/4885
US-20070049615-A1 Compounds and methods for development of Ret modulators RET, GFRA1, GFRA3 PAK1 562/4885CDK8 2155/4885PKN1 2591/4885

“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.