SCHEMBL3798103

SCHEMBL3798103

Cc1csc2ncnc(Nc3cccc(F)c3OC3CCOC3)c12

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.40
MKNK1 Q9BUB5 8/20 0.40
MKNK2 Q9HBH9 8/20 0.40
MRGPRX1 Q96LB2 1/20 0.40
LMNA P02545 1/20 0.40
RAB9A P51151 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
NOD2 Q9HC29 1/20 0.40
EGFR P00533 4/20 0.40
PIP4K2C Q8TBX8 1/20 0.38
FGFR1 P11362 1/20 0.37
CDK2 P24941 1/20 0.36
FLT3 P36888 1/20 0.36
CCNA1 P78396 1/20 0.36
ERBB2 P04626 1/20 0.36
SRC P12931 1/20 0.36

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
SCHEMBL3797693 0.85 MAPK1 (0.44) IRAK4MKNK1MKNK2MRGPRX1LMNA
SCHEMBL3795962 0.85 MKNK1 (0.44) IRAK4MKNK1MKNK2MRGPRX1LMNA
SCHEMBL3795968 0.85 MKNK1 (0.44) IRAK4MKNK1MKNK2MRGPRX1LMNA
SCHEMBL3797145 0.85 MKNK1 (0.44) IRAK4MKNK1MKNK2MRGPRX1LMNA
SCHEMBL3795880 0.83 MKNK2 (0.49) MKNK1MKNK2EGFRSRC
SCHEMBL3799692 0.82 RAB9A (0.44) IRAK4LMNARAB9AEGFRFGFR1
SCHEMBL3804308 0.82 MKNK2 (0.56) MKNK1MKNK2
SCHEMBL3808638 0.80 PIP4K2C (0.53) IRAK4MKNK2LMNAEGFRPIP4K2C
SCHEMBL3798481 0.79 MKNK2 (0.47) IRAK4MKNK1MKNK2MRGPRX1LMNA
SCHEMBL16161827 0.78 MKNK2 (0.47) MKNK1MKNK2EGFRFGFR1SRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100143341-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2010-06-10 US claimed
EP-1899353-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DeveloGen Aktiengesellschaft (DE) 2008-03-19 EP claimed
WO-2006136402-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2006-12-28 WO claimed
US-20100247517-A1 USE OF MNK INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE Boehringer Ingelheim Internationational GmbH (DE) 2010-09-30 US disclosed
US-20100143341-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2010-06-10 US disclosed
EP-1899353-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DeveloGen Aktiengesellschaft (DE) 2008-03-19 EP disclosed
WO-2006136402-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DEVELOGEN AKTIENGESELLSCHAFT (DE) 2006-12-28 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 (2 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-20100247517-A1 USE OF MNK INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE NEK9, TTBK1, NEK2 IRAK4 1595/4885MKNK1 14/4885MKNK2 11/4885
US-20100143341-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DTYMK, CMPK1, PDXK IRAK4 1840/4885MKNK1 74/4885MKNK2 21/4885

“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.