SCHEMBL20158765

SCHEMBL20158765

CCOc1nc2c(Br)cc(Br)cc2n1CC1CC1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 5/20 0.48
CNR2 P34972 8/20 0.36
ACACB O00763 4/20 0.34
PTGER4 P35408 1/20 0.34
GRIN1 Q05586 1/20 0.32
GRIN2B Q13224 1/20 0.32
KCNH2 Q12809 1/20 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
SCHEMBL18164352 0.89 GRM2 (0.39) GRM2CNR2ACACBPTGER4GRIN1
SCHEMBL18164351 0.86 GRM2 (0.37) GRM2CNR2ACACBPTGER4GRIN1
SCHEMBL23073274 0.83 GRM2 (0.35) GRM2CNR2ACACB
SCHEMBL18152777 0.82 GRM2 (0.34) GRM2CNR2ACACBKCNH2
SCHEMBL23473109 0.81 CNR2 (0.33) GRM2CNR2ACACBGRIN1GRIN2B
SCHEMBL18164550 0.81 CNR2 (0.36) GRM2CNR2ACACBGRIN1GRIN2B
SCHEMBL8010918 0.76 EGFR (0.41) GRM2
SCHEMBL18164393 0.71 GRM2 (0.37) GRM2CNR2
SCHEMBL18164379 0.69 GRM2 (0.36) GRM2CNR2GRIN1GRIN2BKCNH2
SCHEMBL18152808 0.69 CNR2 (0.37) GRM2CNR2ACACBGRIN1GRIN2B

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-20180134710-A1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2018-05-17 US disclosed
US-20180134710-A1 BROMODOMAIN INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2018-05-17 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-20180134710-A1 BROMODOMAIN INHIBITORS BRD3, EP300, BRPF3 GRM2 2764/4885CNR2 3909/4885ACACB 279/4885

“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.