SCHEMBL4213010

SCHEMBL4213010

O=Cc1ccc2c(n1)CCN(C(=O)O)CC2

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FGFR4 P22455 15/20 0.36
CCR1 P32246 1/20 0.34
GRM5 P41594 2/20 0.34
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
PTGS1 P23219 1/20 0.32

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
SCHEMBL4206517 0.87 GRM5 (0.33) GRM5MEN1MAPTKMT2ATAAR1
SCHEMBL13568077 0.80 ESR2 (0.49) GRM5MEN1MAPTKMT2A
SCHEMBL4011215 0.80 GRM5 (0.36) GRM5MEN1MAPTKMT2ATAAR1
SCHEMBL28935833 0.78 GRM5 (0.37) GRM5MEN1MAPTKMT2ATAAR1
SCHEMBL4208644 0.75 NOTUM (0.36) GRM5MEN1MAPTKMT2A
SCHEMBL4215846 0.75 HPGD (0.43) MEN1MAPTKMT2A
SCHEMBL4202771 0.75 HCAR3 (0.37) GRM5PTGS1
SCHEMBL4008920 0.75 GRM5 (0.53) GRM5MEN1KMT2A
SCHEMBL4337461 0.74 HTR2A (0.48) MAPT
SCHEMBL4203495 0.74 GRM5 (0.38) GRM5PTGS1

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
EP-2094695-A1 TETRAHYDRO-5H-PYRIDO[2,3-D]AZEPINES AS 5-HT2C LIGANDS Cascade Therapeutics Inc. (CA) 2009-09-02 EP disclosed
WO-2008009125-A1 TETRAHYDRO-5H-PYRIDO[2,3-D]AZEPINES AS 5-HT2C LIGANDS CASCADE THERAPEUTICS INC. (CA) 2008-01-24 WO 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 FGFR4 2229/4885CCR1 2649/4885GRM5 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.