SCHEMBL3938262

SCHEMBL3938262

Cc1[nH]c2c(F)ccc(C)c2c1CCNc1ncnc2cc(-c3cccc(CO)c3)sc12

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 3/20 0.42
CHUK O15111 3/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
TYK2 P29597 1/20 0.39
FLT1 P17948 9/20 0.38
EGFR P00533 7/20 0.38
KDR P35968 1/20 0.37
RIPK2 O43353 1/20 0.35
MAP3K8 P41279 1/20 0.34
STK17B O94768 1/20 0.34
NTRK1 P04629 1/20 0.33

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
SCHEMBL3930368 0.93 NPC1 (0.45) IKBKBCHUKNPC1RAB9ATYK2
SCHEMBL4071195 0.91 FLT1 (0.46) IKBKBCHUKNPC1RAB9ATYK2
SCHEMBL4069302 0.90 NPC1 (0.44) NPC1RAB9ATYK2FLT1EGFR
SCHEMBL3930923 0.90 NPC1 (0.42) NPC1RAB9ATYK2FLT1EGFR
SCHEMBL4070223 0.90 NPC1 (0.38) IKBKBCHUKNPC1RAB9ATYK2
SCHEMBL3930445 0.90 FLT1 (0.43) IKBKBCHUKNPC1RAB9ATYK2
SCHEMBL4065656 0.89 FLT1 (0.45) IKBKBCHUKNPC1RAB9ATYK2
SCHEMBL4073363 0.88 NPC1 (0.43) NPC1RAB9ATYK2FLT1EGFR
SCHEMBL3937751 0.88 NPC1 (0.46) NPC1RAB9ATYK2FLT1EGFR
SCHEMBL4068409 0.88 TYK2 (0.53) NPC1RAB9ATYK2FLT1EGFR

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-20090042913-A1 Indolylalkylthienopyrimidylamines as modulators of the EP2 receptor BAYER SCHERING PHARMA AG (DE) 2009-02-12 US claimed
US-20090042913-A1 Indolylalkylthienopyrimidylamines as modulators of the EP2 receptor BAYER SCHERING PHARMA AG (DE) 2009-02-12 US disclosed
US-20090042913-A1 Indolylalkylthienopyrimidylamines as modulators of the EP2 receptor BAYER SCHERING PHARMA AG (DE) 2009-02-12 US disclosed
US-20090042913-A1 Indolylalkylthienopyrimidylamines as modulators of the EP2 receptor BAYER SCHERING PHARMA AG (DE) 2009-02-12 US disclosed
WO-2009007421-A1 INDOLYLALKYLTHIENOPYRIMIDYLAMINES AS MODULATORS OF THE EP2 RECEPTOR BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-01-15 WO disclosed
EP-2014662-A1 Indolyl alkyl thieno-pyrimidyl amines as modulators of EP2 receptors Bayer Schering Pharma Aktiengesellschaft (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-20090042913-A1 Indolylalkylthienopyrimidylamines as modulators of the EP2 receptor PTGER2, PTGER1, PTGDR2 IKBKB 2039/4885CHUK 1623/4885NPC1 2246/4885

“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.