SCHEMBL985478

SCHEMBL985478

COCC(=O)N1CCC[C@@H](NC(=O)c2c[nH]c3c(-c4cc(OC)c(F)cc4OCC4CC4)ncnc23)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.39
MDM4 O15151 1/20 0.35
SCN9A Q15858 1/20 0.35
BTK Q06187 5/20 0.35
GAA P10253 1/20 0.34
KAT8 Q9H7Z6 2/20 0.34
KAT7 O95251 2/20 0.33
KAT6A Q92794 2/20 0.33
KAT5 Q92993 2/20 0.33
ALDH1A1 P00352 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33
YES1 P07947 1/20 0.33
LYN P07948 1/20 0.33
FGR P09769 1/20 0.33
SRC P12931 1/20 0.33
CSK P41240 1/20 0.33
TEC P42680 1/20 0.33
TXK P42681 1/20 0.33
FRK P42685 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
SCHEMBL984462 0.97 POLB (0.39) POLBMDM4SCN9ABTKGAA
SCHEMBL981629 0.97 POLB (0.39) POLBMDM4SCN9ABTKGAA
SCHEMBL982066 0.96 MDM4 (0.37) POLBMDM4BTKKAT8KAT6A
SCHEMBL985168 0.95 POLB (0.37) POLBMDM4SCN9ABTKGAA
SCHEMBL985371 0.94 PIK3CD (0.37) POLBMDM4SCN9ABTKJAK3
SCHEMBL982545 0.93 MDM4 (0.37) POLBMDM4BTKKAT8KAT6A
SCHEMBL982924 0.92 MDM4 (0.36) POLBMDM4SCN9ABTKJAK3
SCHEMBL984230 0.92 BTK (0.39) MDM4BTK
SCHEMBL984636 0.91 PIK3CD (0.37) POLBMDM4SCN9ABTKJAK3
SCHEMBL983553 0.91 PIK3CD (0.37) POLBMDM4SCN9ABTKJAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110021479-A1 PYRROLOPYRIMIDINECARBOXAMIDES NYCOMED GMBH (DE) 2011-01-27 US claimed
US-20110021479-A1 PYRROLOPYRIMIDINECARBOXAMIDES NYCOMED GMBH (DE) 2011-01-27 US 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-20110021479-A1 PYRROLOPYRIMIDINECARBOXAMIDES PDE5A, PDE3A, PDE2A POLB 242/4885MDM4 2898/4885SCN9A 893/4885

“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.