SCHEMBL4366969

SCHEMBL4366969

COc1noc(C)c1CON

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.35
GRIA2 P42262 1/20 0.35
GRIA3 P42263 1/20 0.35
GRIA4 P48058 1/20 0.35
ALDH1A1 P00352 2/20 0.34
AGXT P21549 2/20 0.32
HTT P42858 1/20 0.31
LMNA P02545 1/20 0.31
IDO1 P14902 1/20 0.31
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
Hydrochloric Acid SCHEMBL6613519 0.98 GRIA1 (0.34) GRIA1GRIA2GRIA3GRIA4ALDH1A1
SCHEMBL18083203 0.78 APOBEC3A (0.36) GRIA1GRIA2GRIA3GRIA4ALDH1A1
SCHEMBL402220 0.78 GAA (0.45) ALDH1A1HTTLMNANPSR1
Hydrochloric Acid SCHEMBL1716042 0.76 GAA (0.44) ALDH1A1HTTLMNANPSR1
SCHEMBL6609431 0.76 GRIA1 (0.33) GRIA1GRIA2GRIA3GRIA4ALDH1A1
SCHEMBL17000229 0.73 GRIA1 (0.41) GRIA1GRIA2GRIA3GRIA4ALDH1A1
SCHEMBL5425511 0.70 CYP1A2 (0.36) GRIA1GRIA2GRIA3GRIA4ALDH1A1
SCHEMBL5425505 0.69 CYP1A2 (0.35) GRIA1GRIA2GRIA3GRIA4ALDH1A1
SCHEMBL14562467 0.69 CYP1A2 (0.35) GRIA1GRIA2GRIA3GRIA4ALDH1A1
SCHEMBL4373865 0.68

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 7 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
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
US-20030040518-A1 Isatine derivatives with neurotrophic activity ANIONA APS (DK) 2003-02-27 US 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 GRIA1 2063/4885GRIA2 1785/4885GRIA3 653/4885
US-20030040518-A1 Isatine derivatives with neurotrophic activity BDNF, NTRK2, NGF GRIA1 2063/4885GRIA2 1785/4885GRIA3 653/4885

“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.