SCHEMBL13593167

SCHEMBL13593167

CC1CN(C=O)CCN1C(=O)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMO Q99835 11/20 0.51
HTT P42858 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
ACHE P22303 1/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46
RECQL P46063 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
GHSR Q92847 1/20 0.45
PTGDR2 Q9Y5Y4 1/20 0.44

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
SCHEMBL20750506 0.87 GAA (0.47) SMOHTTL3MBTL1GAAHPGD
SCHEMBL29259938 0.85 DRD3 (0.60) GAAHPGDTSHRRECQLSMN1; SMN2
SCHEMBL252505 0.82 ACHE (0.55) SMOHTTL3MBTL1ACHEGAA
SCHEMBL18080914 0.81 SMO (0.53) SMOHTTL3MBTL1ACHEGAA
SCHEMBL10938522 0.80 ACHE (0.53) SMOHTTL3MBTL1ACHEGAA
SCHEMBL3712727 0.80 HTT (0.62) SMOHTTL3MBTL1ACHEGAA
SCHEMBL26828135 0.79 HTT (0.60) SMOHTTL3MBTL1ACHETSHR
SCHEMBL20012722 0.78 PTGDR2 (0.54) SMOHTTL3MBTL1ACHEGAA
SCHEMBL20008967 0.78 SMO (0.50) SMOHTTL3MBTL1ACHEGAA
SCHEMBL19454030 0.77 HPGD (0.64) SMOL3MBTL1ACHEGAAHPGD

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-7501420-B2 Composition and antiviral of substituted azaindoleoxoacetic piperazine derivatives BRISTOL-MYERS SQUIBB COMPANY (US) 2009-03-10 US disclosed
US-20080119480-A1 COMPOSITION AND ANTIVIRAL ACTIVITY OF SUBSTITUTED AZAINDOLEOXOACETIC PIPERAZINE DERIVATIVES BRISTOL-MYERS SQUIBB COMPANY 2008-05-22 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-20080119480-A1 COMPOSITION AND ANTIVIRAL ACTIVITY OF SUBSTITUTED AZAINDOLEOXOACETIC PIPERAZINE DERIVATIVES ITPA, IDO1, IDO2 SMO 3980/4885HTT 3152/4885L3MBTL1 4805/4885

“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.