SCHEMBL35211879

SCHEMBL35211879

CCCn1c(=O)c(C(N)=O)cc2cnncc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.42
EEF2K O00418 3/20 0.42
CNR2 P34972 2/20 0.41
CNR1 P21554 1/20 0.39
ADORA2A P29274 1/20 0.36
ADORA2B P29275 1/20 0.36
MAP3K7 O43318 1/20 0.36
PARP1 P09874 4/20 0.35
SRC P12931 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
CYP2C19 P33261 1/20 0.35
HSD17B10 Q99714 1/20 0.35
PARP2 Q9UGN5 1/20 0.34
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34

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
SCHEMBL35211845 0.89 EEF2K (0.46) EEF2KCNR2SRCKDM4EALDH1A1
SCHEMBL35212407 0.81 MAPK1 (0.37) EEF2KCNR2PARP1SRCKDM4E
SCHEMBL6547150 0.67 MAPK1 (0.47) NPC1EEF2KCNR2CNR1KDM4E
SCHEMBL29539222 0.66 CNR2 (0.46) NPC1CNR2CNR1KDM4EALDH1A1
SCHEMBL35211826 0.66 SIRT3 (0.45) KDM4EALDH1A1HSD17B10
SCHEMBL16627569 0.66 CNR1 (0.60) NPC1CNR2CNR1KDM4EALDH1A1
SCHEMBL35211579 0.63 KDM4E (0.48) KDM4E
SCHEMBL31602802 0.62 AR (0.44) ALDH1A1
SCHEMBL31169520 0.62 AR (0.47)
SCHEMBL27273912 0.62 AR (0.47)

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-20260124198-A1 ANTIVIRAL PYRAZOLOPYRIDINONE COMPOUNDS GILEAD SCIENCES INC (US) 2026-05-07 US claimed
US-20260124198-A1 ANTIVIRAL PYRAZOLOPYRIDINONE COMPOUNDS GILEAD SCIENCES INC (US) 2026-05-07 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-20260124198-A1 ANTIVIRAL PYRAZOLOPYRIDINONE COMPOUNDS ZC3HAV1, CCR1, CCR6 NPC1 276/4885EEF2K 2982/4885CNR2 624/4885

“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.