SCHEMBL3345892

SCHEMBL3345892

CCc1[c]cc2c(c1)c(C(N)=O)cn2CCO

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ICMT O60725 1/20 0.39
CNR2 P34972 6/20 0.36
CNR1 P21554 4/20 0.36
MAP2K2 P36507 1/20 0.33
MAP2K1 Q02750 1/20 0.33
PIM1 P11309 1/20 0.32
TTK P33981 1/20 0.32
PIM2 Q9P1W9 1/20 0.32
P2RX7 Q99572 1/20 0.32
ENPP2 Q13822 1/20 0.31

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
SCHEMBL3342625 0.84 ICMT (0.41) ICMTCNR2CNR1MAP2K2MAP2K1
SCHEMBL3345890 0.70 MCL1 (0.33) CNR2
SCHEMBL3345732 0.69 BRD4 (0.34) PIM2
SCHEMBL3339362 0.65 KDM4E (0.37) ICMTMAP2K2MAP2K1
SCHEMBL3650821 0.64 CNR1 (0.45) ICMTCNR2CNR1
SCHEMBL1744602 0.63 CNR2 (0.31) CNR2
SCHEMBL3345983 0.63 NR4A2 (0.43) ICMTCNR1MAP2K2MAP2K1
SCHEMBL28131233 0.61 ICMT (0.55) ICMTCNR2CNR1MAP2K2MAP2K1
SCHEMBL15281975 0.60 KMT2A (0.51) CNR2CNR1MAP2K2MAP2K1
SCHEMBL3483096 0.59 CREBBP (0.48) CNR2CNR1P2RX7

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-8372865-B2 Dihydropyridone amides as P2X7 modulators ROCHE PALO ALTO LLC (US) 2013-02-12 US claimed
US-8372865-B2 Dihydropyridone amides as P2X7 modulators ROCHE PALO ALTO LLC (US) 2013-02-12 US disclosed
US-20100160373-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS ROCHE PALO ALTO LLC 2010-06-24 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-20100160373-A1 DIHYDROPYRIDONE AMIDES AS P2X7 MODULATORS P2RY1, P2RX3, P2RX1 ICMT 4736/4885CNR2 62/4885CNR1 36/4885

“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.