SCHEMBL4070018

SCHEMBL4070018

CN(c1ccco1)c1ncnc2cc(-c3ccccc3)sc12

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 1/20 0.50
FLT1 P17948 9/20 0.47
EGFR P00533 6/20 0.47
POLB P06746 1/20 0.44
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAP3K8 P41279 1/20 0.39
KDR P35968 2/20 0.39
TYK2 P29597 1/20 0.38
CLK4 Q9HAZ1 2/20 0.38
STK17B O94768 2/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL4073207 0.74 IKBKB (0.53) IKBKBFLT1EGFRPOLBNPC1
SCHEMBL4069658 0.73 EGFR (0.47) IKBKBFLT1EGFRPOLBNPC1
SCHEMBL4074719 0.72 EGFR (0.46) IKBKBFLT1EGFRPOLBMAPT
SCHEMBL4065156 0.71 IKBKB (0.50) IKBKBFLT1EGFRPOLBMAPT
SCHEMBL16281232 0.70 IKBKB (0.67) IKBKBFLT1EGFRNPC1RAB9A
SCHEMBL2368309 0.69 LMNA (0.55) FLT1POLBSMN1; SMN2KDRCLK4
SCHEMBL4070015 0.68 SMN1; SMN2 (0.57) IKBKBFLT1EGFRPOLBRAB9A
SCHEMBL4075049 0.68 MAP3K8 (0.45) IKBKBFLT1EGFRMAPTSMN1; SMN2
SCHEMBL2879120 0.68 NPC1 (0.67) IKBKBFLT1EGFRNPC1RAB9A
SCHEMBL7121617 0.68 IKBKB (0.67) IKBKBFLT1EGFRNPC1RAB9A

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
US-20090042878-A1 THIENOPYRIMIDYLAMINES AS MODULATORS OF THE EP2 RECEPTOR BAYER SHERING PHARMA AG (DE) 2009-02-12 US claimed
EP-2014663-A1 Thieno-pyrimidyl amines as modulators of EP2 receptors Bayer Schering Pharma AG (DE) 2009-01-14 EP claimed
US-20090042878-A1 THIENOPYRIMIDYLAMINES AS MODULATORS OF THE EP2 RECEPTOR BAYER SHERING PHARMA AG (DE) 2009-02-12 US disclosed
EP-2014663-A1 Thieno-pyrimidyl amines as modulators of EP2 receptors Bayer Schering Pharma AG (DE) 2009-01-14 EP 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 (1 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-20090042878-A1 THIENOPYRIMIDYLAMINES AS MODULATORS OF THE EP2 RECEPTOR PTGER2, PTGER1, PTGDR2 IKBKB 2889/4885FLT1 3521/4885EGFR 875/4885

“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.