SCHEMBL4212866

SCHEMBL4212866

CN(c1ccccc1)c1ccc2c(n1)CCN(C(=O)OC(C)(C)C)CC2

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.46
ESR2 Q92731 1/20 0.44
MAPT P10636 2/20 0.44
GPR119 Q8TDV5 1/20 0.41
CKS1B P61024 2/20 0.41
SKP1 P63208 2/20 0.41
SKP2 Q13309 2/20 0.41
KDM4E B2RXH2 1/20 0.40
PKM P14618 1/20 0.40
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
GRM5 P41594 2/20 0.39
PTPN11 Q06124 1/20 0.39
GRM1 Q13255 1/20 0.39
JAK2 O60674 1/20 0.39
JAK3 P52333 1/20 0.39
PTK2 Q05397 1/20 0.39
PDK4 Q16654 1/20 0.39
MAPK1 P28482 1/20 0.38

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
SCHEMBL4198464 0.86 NR1H2 (0.51) NR1H2ESR2MAPTGPR119CKS1B
SCHEMBL4211280 0.84 JAK2 (0.46) NR1H2ESR2MAPTGPR119CKS1B
SCHEMBL13568094 0.83 NR1H2 (0.48) NR1H2ESR2MAPTGPR119CKS1B
SCHEMBL4215851 0.83 NR1H2 (0.44) NR1H2ESR2MAPTGPR119CKS1B
SCHEMBL4201235 0.82 NR1H2 (0.47) NR1H2ESR2MAPTGPR119CKS1B
SCHEMBL13568088 0.82 NR1H2 (0.47) NR1H2ESR2MAPTGPR119GRM5
SCHEMBL4208910 0.81 NR1H2 (0.48) NR1H2ESR2MAPTGPR119CKS1B
SCHEMBL13568084 0.80 NR1H2 (0.46) NR1H2ESR2MAPTGPR119CKS1B
SCHEMBL4204473 0.80 NR1H2 (0.46) NR1H2ESR2MAPTGPR119GRM5
SCHEMBL13568074 0.80 CKS1B (0.49) NR1H2ESR2MAPTGPR119CKS1B

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-20090312306-A1 TETRAHYDRO-5H-PYRIDO[2,3-D]AZEPINES AS 5-HT2C LIGANDS CASCADE THERAPEUTICS INC. (CA) 2009-12-17 US disclosed
US-20090312306-A1 TETRAHYDRO-5H-PYRIDO[2,3-D]AZEPINES AS 5-HT2C LIGANDS CASCADE THERAPEUTICS INC. (CA) 2009-12-17 US disclosed
US-20090312306-A1 TETRAHYDRO-5H-PYRIDO[2,3-D]AZEPINES AS 5-HT2C LIGANDS CASCADE THERAPEUTICS INC. (CA) 2009-12-17 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-20090312306-A1 TETRAHYDRO-5H-PYRIDO[2,3-D]AZEPINES AS 5-HT2C LIGANDS HTR2C, HTR2A, HTR5A NR1H2 873/4885ESR2 550/4885MAPT 2939/4885

“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.