SCHEMBL3451548

SCHEMBL3451548

Cc1c(Br)cn(CCS(C)(=O)=O)c(=O)c1C(N)=O

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 2/20 0.35
▸ FAAH O00519 1/20 0.35
▸ CNR1 P21554 1/20 0.35
▸ ABHD12 Q8N2K0 1/20 0.35
▸ TNF P01375 2/20 0.33
▸ MAPT P10636 1/20 0.31
▸ ACP1 P24666 1/20 0.30

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
SCHEMBL28861326 0.70 BRD4 (0.44) CNR2MAPT
SCHEMBL3449664 0.69 MKNK1 (0.39) CNR2FAAHCNR1ABHD12TNF
SCHEMBL18584783 0.69 CNR2 (0.57) CNR2FAAHCNR1ABHD12MAPT
SCHEMBL18584997 0.67 CNR2 (0.43) CNR2FAAHCNR1ABHD12
SCHEMBL3450711 0.65 MAPT (0.42) CNR2CNR1MAPT
SCHEMBL19874000 0.63 ALDH1A1 (0.34) TNF
SCHEMBL28652146 0.63 CDK9 (0.40) TNFMAPT
SCHEMBL28227744 0.63 BRD4 (0.43) CNR2CNR1TNFMAPT
SCHEMBL23121684 0.62 TYR (0.40) CNR2CNR1TNF
SCHEMBL3450311 0.62 GPR35 (0.37) CNR2FAAHCNR1ABHD12

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 — — 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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF SDHA, SDHB, UROD CNR2 517/4885FAAH 1978/4885CNR1 653/4885

“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.

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