SCHEMBL506282

SCHEMBL506282

CC(C)(C)OC(=O)N1CCc2ccc(Cl)c(OCc3ccc(F)cc3)c2CC1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.48
HPD P32754 1/20 0.41
KDM1A O60341 1/20 0.41
NR1H2 P55055 1/20 0.40
GPR119 Q8TDV5 8/20 0.40
PTGER4 P35408 1/20 0.38
GRM5 P41594 1/20 0.38
GRM1 Q13255 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL506141 0.87 GPR119 (0.49) ESR2NR1H2GPR119
SCHEMBL506191 0.80 ESR2 (0.47) ESR2KDM1ANR1H2GPR119GRM5
SCHEMBL507080 0.78 ESR2 (0.46) ESR2NR1H2GPR119MEN1KMT2A
SCHEMBL507182 0.77 ESR2 (0.42) ESR2KDM1ANR1H2GPR119PTGER4
SCHEMBL2206790 0.76 ESR2 (0.48) ESR2NR1H2GPR119MEN1KMT2A
SCHEMBL506203 0.76 ESR2 (0.57) ESR2NR1H2GPR119MEN1KMT2A
SCHEMBL30200125 0.76 NR1H2 (0.57) ESR2NR1H2GPR119
SCHEMBL29098082 0.76 NR1H2 (0.57) ESR2NR1H2GPR119
SCHEMBL2254528 0.75 ESR2 (0.51) ESR2NR1H2GPR119MEN1KMT2A
SCHEMBL2256587 0.75 ESR2 (0.51) ESR2NR1H2GPR119MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8580780-B2 6 substituted 2, 3,4,5 tetrahydro-1H-benzo[d]azepines as 5-HT2C receptor agonist ELI LILLY AND COMPANY (US) 2013-11-12 US disclosed
EP-2479168-A1 6-Substituted 2,3,4,5-Tetrahydro-1H-Benzo [d]Azepines as 5-HT2C Receptor Agonists ELI LILLY AND COMPANY (US) 2012-07-25 EP disclosed
US-20120028961-A1 6 Substituted 2, 3,4,5 Tetrahydro-1H-Benzo[d]Azepines as 5-HT2c Receptor Agonist ELI LILLY AND COMPANY (US) 2012-02-02 US disclosed
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 (2 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 ESR2 210/4885HPD 3016/4885KDM1A 1832/4885
US-20120028961-A1 6 Substituted 2, 3,4,5 Tetrahydro-1H-Benzo[d]Azepines as 5-HT2c Receptor Agonist HTR2C, HTR4, HTR1A ESR2 319/4885HPD 1692/4885KDM1A 1338/4885

“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.