SCHEMBL1362778

SCHEMBL1362778

COc1cc(Cc2ccnc3[nH]ccc23)cc(OC)c1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 2/20 0.54
FGFR4 P22455 1/20 0.54
KDR P35968 1/20 0.50
ROCK1 Q13464 4/20 0.48
ROCK2 O75116 4/20 0.48
CCNK O75909 2/20 0.46
CDK12 Q9NYV4 2/20 0.46
CSF1R P07333 1/20 0.46
BRD4 O60885 1/20 0.46
PRKCI P41743 2/20 0.41
CIT O14578 2/20 0.41
AXL P30530 1/20 0.41
TNIK Q9UKE5 1/20 0.41
TTBK1 Q5TCY1 1/20 0.41
TTBK2 Q6IQ55 1/20 0.41
NUDT1 P36639 1/20 0.41
CALM1 P0DP23 1/20 0.40

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
SCHEMBL28331274 0.89 CCNK (0.54) FGFR1FGFR4ROCK1ROCK2CCNK
SCHEMBL878696 0.81 FGFR4 (0.81) FGFR1FGFR4ROCK2CSF1RBRD4
SCHEMBL12127494 0.77 BRD4 (0.70) FGFR1KDRROCK1ROCK2CCNK
SCHEMBL5322848 0.75 LMNA (0.52) FGFR1FGFR4CSF1R
SCHEMBL22664552 0.74 BRD4 (0.43) FGFR1FGFR4ROCK1ROCK2CCNK
SCHEMBL14416607 0.73 PRKCI (0.50) FGFR1KDRROCK1CCNKCDK12
SCHEMBL239630 0.73 NUDT1 (0.54) FGFR1KDRROCK1CCNKCDK12
SCHEMBL1329521 0.72 CCNK (0.44) FGFR1KDRROCK1ROCK2CCNK
SCHEMBL29540648 0.71 CCNK (0.56) ROCK1ROCK2CCNKCDK12BRD4
SCHEMBL99955 0.71 CCNK (0.56) ROCK1ROCK2CCNKCDK12BRD4

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 9 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-20100324065-A1 Compounds and methods for development of Ret Modulators PLEXXIKON INC 2010-12-23 US disclosed
EP-1696920-A4 COMPOUNDS AND METHODS FOR DEVELOPMENT OF RET MODULATORS PLEXXIKON INC (US) 2009-09-02 EP 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-20070049615-A1 Compounds and methods for development of Ret modulators PLEXXIKON, INC. 2007-03-01 US disclosed
EP-1696920-A2 COMPOUNDS AND METHODS FOR DEVELOPMENT OF RET MODULATORS PLEXXIKON, INC. (US) 2006-09-06 EP disclosed
WO-2005062795-A2 COMPOUNDS AND METHODS FOR DEVELOPMENT OF RET MODULATORS PLEXXIKON, INC. (US) 2005-07-14 WO 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 FGFR1 7/4885FGFR4 21/4885KDR 43/4885
US-20070066641-A1 Compounds and methods for development of RET modulators RET, FGFR1, FGFR3 FGFR1 2/4885FGFR4 5/4885KDR 24/4885
US-20070049615-A1 Compounds and methods for development of Ret modulators RET, GFRA1, GFRA3 FGFR1 10/4885FGFR4 31/4885KDR 103/4885

“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.