SCHEMBL2255200

SCHEMBL2255200

CC(C)(C)OC(=O)N1CCc2ccc(Cl)c(COc3ccccc3)c2CC1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.47
NR1H2 P55055 1/20 0.42
GPR119 Q8TDV5 4/20 0.40
POLB P06746 1/20 0.40
YAP1 P46937 2/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
PRMT5 O14744 2/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
WDR77 Q9BQA1 1/20 0.39
STS P08842 1/20 0.39
MAPK1 P28482 1/20 0.39
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39

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
SCHEMBL2254528 0.83 ESR2 (0.51) ESR2NR1H2GPR119POLBPRMT5
SCHEMBL2256587 0.83 ESR2 (0.51) ESR2NR1H2GPR119POLBPRMT5
SCHEMBL2254895 0.82 ESR2 (0.44) ESR2NR1H2GPR119POLBPRMT5
SCHEMBL2253554 0.82 ESR2 (0.50) ESR2NR1H2GPR119POLBPRMT5
SCHEMBL2254913 0.82 ESR2 (0.50) ESR2NR1H2GPR119POLBPRMT5
SCHEMBL2255061 0.82 ESR2 (0.50) ESR2NR1H2GPR119POLBPRMT5
SCHEMBL2253767 0.82 ESR2 (0.43) ESR2NR1H2GPR119OPRD1OPRK1
SCHEMBL507908 0.80 YAP1 (0.46) ESR2GPR119YAP1PRMT5
SCHEMBL14115666 0.79 ESR2 (0.49) ESR2NR1H2GPR119POLBPRMT5
SCHEMBL3961806 0.79 ESR2 (0.46) ESR2NR1H2GPR119POLBPRMT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7994163-B2 e.g. 3-tert-Butoxycarbonyl-7-chloro-6-chloromethyl-2,3,4,5-tetrahydro-1H-benzo[d]azepine; serotonin receptor agonist; antidepressant, anxiolytic agent; obesity, obsessive compulsive disorder ELI LILLY AND COMPANY (US) 2011-08-09 US disclosed
EP-1924560-B1 6-SUBSTITUTED- 2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINES AS 5-HT2C RECEPTOR AGONISTS LILLY CO ELI (US) 2009-08-05 EP disclosed
US-20080255092-A1 6-Substituted-2,3,4,5-Tetrahydro-1H-Benzo[d]Azepines as 5-Ht2c Receptor Agonists ELI LILLY AND COMPANY 2008-10-16 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-20080255092-A1 6-Substituted-2,3,4,5-Tetrahydro-1H-Benzo[d]Azepines as 5-Ht2c Receptor Agonists HTR2C, HTR3C, HTR3A ESR2 256/4885NR1H2 197/4885GPR119 38/4885

“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.