SCHEMBL17176296

SCHEMBL17176296

Cn1nccc1C(=O)N1CCC(C)(C)C1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.55
PKM P14618 1/20 0.55
KMT2A Q03164 2/20 0.52
L3MBTL1 Q9Y468 2/20 0.47
ATM Q13315 1/20 0.45
PIK3CD O00329 1/20 0.42
SPR P35270 1/20 0.42
NAMPT P43490 1/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
HTT P42858 1/20 0.41
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL17173105 0.85 KDM4E (0.49) KDM4EPKMKMT2AL3MBTL1ATM
SCHEMBL12108494 0.79 KDM4E (0.66) KDM4EPKMKMT2AL3MBTL1ATM
SCHEMBL21843845 0.78 KDM4E (0.51) KDM4EPKMKMT2AL3MBTL1ATM
SCHEMBL13779928 0.78 KDM4E (0.68) KDM4EPKMKMT2AL3MBTL1ATM
SCHEMBL27228782 0.76 KDM4E (0.62) KDM4EPKMKMT2AL3MBTL1ATM
SCHEMBL15014509 0.74 KDM4E (0.59) KDM4EPKMKMT2AATMPIK3CD
SCHEMBL14730733 0.73 KDM4E (0.55) KDM4EPKMKMT2AL3MBTL1ATM
SCHEMBL4819498 0.73 CHRNA4 (0.50) KDM4EKMT2AL3MBTL1SPRNAMPT
SCHEMBL4819511 0.73 CHRNA4 (0.50) KDM4EKMT2AL3MBTL1SPRNAMPT
SCHEMBL20438274 0.72 HTT (0.46) KDM4EPKMKMT2AL3MBTL1PIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9260439-B2 Dihydropyrrolopyrimidine derivatives PFIZER INC. (US) 2016-02-16 US disclosed
US-20150291604-A1 DIHYDROPYRROLOPYRIMIDINE DERIVATIVES PFIZER (US) 2015-10-15 US disclosed
WO-2015155624-A1 DIHYDROPYRROLOPYRIMIDINE DERIVATIVES PFIZER INC. (US) 2015-10-15 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-20150291604-A1 DIHYDROPYRROLOPYRIMIDINE DERIVATIVES DPYD, TPD52L2, DTYMK KDM4E 512/4885PKM 460/4885KMT2A 2485/4885

“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.