SCHEMBL4200211

SCHEMBL4200211

Cc1ccc2c(n1)C(C)CN(C(=O)OC(C)(C)C)CC2

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.47
NR1H2 P55055 1/20 0.46
GRM5 P41594 1/20 0.44
GPR119 Q8TDV5 11/20 0.41
SSTR4 P31391 1/20 0.41
IGF1R P08069 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 0.38
MAPT P10636 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
SCHEMBL4208116 0.88 ESR2 (0.50) ESR2NR1H2GRM5GPR119NPC1
SCHEMBL4208199 0.87 ESR2 (0.45) ESR2NR1H2GPR119IGF1RNPC1
SCHEMBL4203910 0.85 ESR2 (0.45) ESR2NR1H2GRM5GPR119IGF1R
SCHEMBL4202663 0.84 ESR2 (0.44) ESR2NR1H2GRM5GPR119NPC1
SCHEMBL8059842 0.84 GPR119 (0.46) ESR2NR1H2GPR119
SCHEMBL4206674 0.84 GPR119 (0.46) ESR2NR1H2GPR119
SCHEMBL8059846 0.84 GPR119 (0.46) ESR2NR1H2GPR119
SCHEMBL4011248 0.83 ESR2 (0.43) ESR2NR1H2GPR119NPC1RAB9A
SCHEMBL4201307 0.83 ESR2 (0.43) ESR2NR1H2GPR119NPC1RAB9A
SCHEMBL4014808 0.83 ESR2 (0.43) ESR2NR1H2GPR119NPC1RAB9A

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 ESR2 550/4885NR1H2 873/4885GRM5 25/4885

“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.