SCHEMBL4370977

SCHEMBL4370977

O=C1Nc2ccc(-c3ccc(Cl)cc3)cc2C1=O

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 5/20 0.73
TGM2 P21980 5/20 0.73
MAOA P21397 5/20 0.72
MAOB P27338 5/20 0.72
PDE3B Q13370 1/20 0.68
PDE3A Q14432 1/20 0.68
SLC6A11 P48066 1/20 0.54
JAK2 O60674 1/20 0.50
NTRK1 P04629 1/20 0.50
MET P08581 1/20 0.50
FGFR1 P11362 1/20 0.50
PRKACA P17612 1/20 0.50
KDR P35968 1/20 0.50
MAP2K2 P36507 1/20 0.50
FLT3 P36888 1/20 0.50
GSK3B P49841 1/20 0.50
MAP2K1 Q02750 1/20 0.50
MST1R Q04912 1/20 0.50
NTRK3 Q16288 1/20 0.50
NTRK2 Q16620 1/20 0.50

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
SCHEMBL134453 0.85 TGM2 (1.00) CES1TGM2MAOAMAOBCA12
SCHEMBL29506317 0.85 TGM2 (1.00) CES1TGM2MAOAMAOBCA12
SCHEMBL3521129 0.85 MAOA (0.71) CES1TGM2MAOAMAOBPDE3B
SCHEMBL25367285 0.84 MAOA (0.74) CES1TGM2MAOAMAOBPDE3B
SCHEMBL30588923 0.84 MAOA (0.74) CES1TGM2MAOAMAOBPDE3B
SCHEMBL2789935 0.84 MAOA (1.00) CES1TGM2MAOAMAOBPDE3B
Methane SCHEMBL27958656 0.83 TGM2 (0.96) CES1TGM2MAOAMAOBCA12
SCHEMBL1462357 0.83 TGM2 (0.96) CES1TGM2MAOAMAOBCA12
SCHEMBL29906173 0.82 MAOB (0.72) CES1TGM2MAOAMAOBPDE3B
SCHEMBL2788548 0.82 MAOB (0.72) CES1TGM2MAOAMAOBPDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7595336-B2 Isatine derivatives with neurotrophic activity NEUROSEARCH A/S (DK) 2009-09-29 US disclosed
US-7282511-B2 Isatine derivatives with neurotrophic activity NEUROSEARCH A/S (DK) 2007-10-16 US disclosed
CN-1298704-C Isatine derivatives with neurotrophic activity NEUROSEARCH AS (DK) 2007-02-07 CN disclosed
EP-1736468-A2 Isatin derivatives with neurotrophic activity useful in the treatment of diseases mediated by the nerve growth factor (NGF) activation NeuroSearch A/S (DK) 2006-12-27 EP disclosed
US-20060229311-A1 Isatine derivatives with neurotrophic activity GROENBORG METTE 2006-10-12 US disclosed
EP-1255734-B1 ISATINE DERIVATIVES WITH NEUROTROPHIC ACTIVITY NEUROSEARCH AS (DK) 2006-06-21 EP disclosed
US-20030040518-A1 Isatine derivatives with neurotrophic activity ANIONA APS (DK) 2003-02-27 US disclosed
CN-1395563-A Isatine derivatives with neurotrophic activity NEUROSEARCH AS (DK) 2003-02-05 CN disclosed
EP-1255734-A1 ISATINE DERIVATIVES WITH NEUROTROPHIC ACTIVITY NeuroSearch A/S (DK) 2002-11-13 EP disclosed
WO-2001055110-A1 ISATINE DERIVATIVES WITH NEUROTROPHIC ACTIVITY NEUROSEARCH A/S (DK) 2001-08-02 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 (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-20060229311-A1 Isatine derivatives with neurotrophic activity BDNF, NTRK2, NGF CES1 4085/4885TGM2 4518/4885MAOA 620/4885
US-20030040518-A1 Isatine derivatives with neurotrophic activity BDNF, NTRK2, NGF CES1 4085/4885TGM2 4518/4885MAOA 620/4885

“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.