SCHEMBL4986167

SCHEMBL4986167

NC(=O)c1n[c]c2c(n1)CN(Cc1cccc(Br)c1)CC2

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 3/20 0.41
CLPP Q16740 2/20 0.41
PARP1 P09874 1/20 0.41
PARP2 Q9UGN5 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 2/20 0.40
FAAH O00519 2/20 0.39
ALDH1A1 P00352 1/20 0.38
HTT P42858 1/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
DRD4 P21917 2/20 0.37
LMNA P02545 1/20 0.37
PRNP P04156 1/20 0.37
PHGDH O43175 1/20 0.37
SIGMAR1 Q99720 1/20 0.36

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
SCHEMBL4988838 0.88 GRM2 (0.47) GRM2CLPPSMN1; SMN2KDM4EFAAH
SCHEMBL4986124 0.88 CLPP (0.42) GRM2CLPPPARP1PARP2KDM4E
SCHEMBL4993338 0.88 CLPP (0.42) GRM2CLPPSMN1; SMN2KDM4EFAAH
SCHEMBL4992456 0.87 MEN1 (0.40) GRM2CLPPPARP1PARP2KDM4E
SCHEMBL4984714 0.87 KMT2A (0.44) PARP1PARP2SMN1; SMN2KDM4EALDH1A1
SCHEMBL4988781 0.86 CLPP (0.45) GRM2CLPPFAAH
SCHEMBL4985028 0.85 KDM4E (0.45) GRM2CLPPKDM4EFAAHALDH1A1
SCHEMBL4985987 0.85 KDM4E (0.44) GRM2PARP1KDM4EFAAHALDH1A1
SCHEMBL4986185 0.84 MC4R (0.44) CLPPFAAHMEN1KMT2ASIGMAR1
SCHEMBL4986723 0.84 KDM4E (0.46) SMN1; SMN2TDP1KDM4EFAAHALDH1A1

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 GRM2 332/4885CLPP 1470/4885PARP1 1754/4885

“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.