SCHEMBL4982898

SCHEMBL4982898

CCCCN1CCc2[c]nc(C(N)=O)nc2C1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.35
GRM5 P41594 1/20 0.35
LMNA P02545 1/20 0.34
TP53 P04637 1/20 0.34
MAPT P10636 1/20 0.34
OPRM1 P35372 3/20 0.34
OPRD1 P41143 3/20 0.34
DRD2 P14416 3/20 0.33
DRD3 P35462 3/20 0.33
HRH1 P35367 2/20 0.33
HTR1A P08908 1/20 0.33
HTR2A P28223 1/20 0.33
HTR7 P34969 1/20 0.33
HTR2B P41595 1/20 0.33
ALDH1A1 P00352 1/20 0.33
THRB P10828 1/20 0.33
HPGD P15428 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HRH2 P25021 1/20 0.32
OPRK1 P41145 2/20 0.32

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
SCHEMBL4988738 0.96 CNR2 (0.39) CNR2GRM5LMNATP53MAPT
SCHEMBL4985381 0.93 PARP1 (0.33) CNR2LMNAMAPTDRD2DRD3
SCHEMBL4989498 0.87 MAPT (0.39) GRM5LMNAMAPTALDH1A1HPGD
SCHEMBL4985154 0.84 GRM5 (0.36) GRM5OPRM1OPRD1ALDH1A1OPRK1
SCHEMBL4989112 0.82 OPRM1 (0.35) OPRM1OPRD1OPRK1
SCHEMBL4986773 0.81 C5AR1 (0.35)
SCHEMBL4991245 0.79 OPRM1 (0.38) OPRM1OPRD1OPRK1
SCHEMBL4987979 0.77 GRM2 (0.34) OPRM1
SCHEMBL4989367 0.77 MEN1 (0.40) LMNATP53MAPTALDH1A1L3MBTL1
SCHEMBL4988820 0.76 TSHR (0.37) CNR2LMNAMAPTALDH1A1L3MBTL1

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-20080039478-A1 Bicycloheteroaryl Compounds as P2X7 Modulators and Uses Thereof RENOVIS, INC. 2008-02-14 US claimed
US-7297700-B2 Bicycloheteroaryl compounds as P2X7 modulators and uses thereof RENOVIS, INC. (US) 2007-11-20 US claimed

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-20080039478-A1 Bicycloheteroaryl Compounds as P2X7 Modulators and Uses Thereof P2RX7, P2RX3, P2RX2 CNR2 42/4885GRM5 231/4885LMNA 1911/4885

“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.