SCHEMBL2369250

SCHEMBL2369250

CC(C)(C)OC(=O)NCC1CCCC(Cc2ccccn2)C1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACACB O00763 9/20 0.48
ACACA Q13085 5/20 0.48
HPGD P15428 2/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CKS1B P61024 1/20 0.45
SKP1 P63208 1/20 0.45
SKP2 Q13309 1/20 0.45
RECQL P46063 1/20 0.44
DRD2 P14416 1/20 0.44
GLS O94925 1/20 0.42
REN P00797 1/20 0.41
CTSD P07339 1/20 0.41
CTSE P14091 1/20 0.41
NAMPT P43490 1/20 0.41
ADORA2A P29274 1/20 0.40
ADORA2B P29275 1/20 0.40

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
SCHEMBL6647123 0.79 EPHX1 (0.48) ACACBACACAKMT2ACKS1BSKP1
SCHEMBL29263714 0.78 KDM4E (0.55) ACACBACACACKS1BSKP1SKP2
SCHEMBL31145134 0.78 DRD2 (0.52) ACACBACACAMEN1KMT2ACKS1B
SCHEMBL29263613 0.77 HTR2A (0.57) ACACBACACACKS1BSKP1SKP2
SCHEMBL30584860 0.75 DRD2 (0.53) DRD2
SCHEMBL29263709 0.75 HTR4 (0.51) ACACBACACACKS1BSKP1SKP2
SCHEMBL4678395 0.74 SMN1; SMN2 (0.61) HPGDMEN1KMT2A
SCHEMBL14548191 0.74 EPHX1 (0.43) ACACBACACAMEN1KMT2ACKS1B
SCHEMBL13579957 0.74 KMT2A (0.44) ACACBACACAKMT2ACKS1BSKP1
SCHEMBL29611056 0.74 SMN1; SMN2 (0.61) HPGDMEN1KMT2A

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-8022062-B2 6-substituted 2,3,4,5-tetrahydro-1H-benzo[d]azepines as 5-HT2C receptor agonists ELI LILLY AND COMPANY (US) 2011-09-20 US disclosed
US-20090099155-A1 6-SUBSTITUTED 2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINES AS 5-HT2C RECEPTOR AGONISTS ARRAY BIOPHARMA, INC. 2009-04-16 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-20090099155-A1 6-SUBSTITUTED 2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINES AS 5-HT2C RECEPTOR AGONISTS HTR2C, HTR5A, HTR4 ACACB 2668/4885ACACA 2716/4885HPGD 3805/4885

“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.