SCHEMBL3795253

SCHEMBL3795253

O=C(c1ccncc1)N1CCC(Oc2ccccc2Nc2ncnc3sccc23)C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
EGFR P00533 8/20 0.41
ERBB2 P04626 3/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
NAMPT P43490 1/20 0.39
PIK3CD O00329 2/20 0.39
NR2F2 P24468 2/20 0.38
STAT3 P40763 1/20 0.38
PIK3CA P42336 1/20 0.38
HTT P42858 1/20 0.37
CASP1 P29466 1/20 0.37
KDR P35968 1/20 0.37

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
SCHEMBL3799171 0.92 PIK3CD (0.43) MEN1KMT2AEGFRERBB2NPC1
SCHEMBL3800042 0.88 EGFR (0.47) MEN1KMT2AEGFRERBB2NPC1
SCHEMBL3795832 0.87 MEN1 (0.43) MEN1KMT2AEGFRERBB2NPC1
SCHEMBL3802210 0.85 MEN1 (0.44) MEN1KMT2AEGFRERBB2NPC1
SCHEMBL3799620 0.85 MEN1 (0.44) MEN1KMT2AEGFRERBB2NPC1
SCHEMBL3805713 0.84 PIK3CD (0.40) EGFRERBB2RAB9AMAPTALDH1A1
SCHEMBL3803006 0.84 PIK3CD (0.46) MEN1KMT2AEGFRERBB2NPC1
SCHEMBL3798859 0.79 PIP4K2A (0.44) MEN1KMT2AEGFRNPC1RAB9A
SCHEMBL3801046 0.79 EGFR (0.46) MEN1KMT2AEGFRNPC1RAB9A
SCHEMBL3798867 0.79 MEN1 (0.48) MEN1KMT2AEGFRERBB2NPC1

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-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-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 (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-20100143341-A1 THIENOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS DTYMK, CMPK1, PDXK MEN1 1106/4885KMT2A 1016/4885EGFR 3787/4885

“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.