SCHEMBL4068974

SCHEMBL4068974

CNC(=O)c1ccc(-c2cc3ncnc(NCCc4c(C)[nH]c5c(F)ccc(C)c45)c3s2)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
TYK2 P29597 1/20 0.42
CDK1 P06493 1/20 0.38
FLT1 P17948 5/20 0.37
STK17B O94768 6/20 0.35
MAP3K8 P41279 3/20 0.35
EGFR P00533 3/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
FDPS P14324 2/20 0.34
STK17A Q9UEE5 1/20 0.34
SYK P43405 1/20 0.34
KDR P35968 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
SCHEMBL4072674 0.92 STK17B (0.44) NPC1RAB9ATYK2FLT1STK17B
SCHEMBL4068409 0.89 TYK2 (0.53) NPC1RAB9ATYK2FLT1MAP3K8
SCHEMBL3937751 0.89 NPC1 (0.46) NPC1RAB9ATYK2FLT1MAP3K8
SCHEMBL4069307 0.88 NPC1 (0.46) NPC1RAB9ATYK2FLT1STK17B
SCHEMBL3939022 0.88 NPC1 (0.45) NPC1RAB9ATYK2FLT1STK17B
SCHEMBL3930368 0.87 NPC1 (0.45) NPC1RAB9ATYK2FLT1EGFR
SCHEMBL3937781 0.87 PRKCI (0.44) NPC1RAB9ATYK2FLT1STK17B
SCHEMBL4065656 0.87 FLT1 (0.45) NPC1RAB9ATYK2FLT1STK17B
SCHEMBL4073363 0.87 NPC1 (0.43) NPC1RAB9ATYK2FLT1STK17B
SCHEMBL3936128 0.87 NPC1 (0.43) NPC1RAB9ATYK2FLT1STK17B

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 5 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
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 NPC1 2246/4885RAB9A 3318/4885TYK2 2539/4885

“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.