SCHEMBL6853483

SCHEMBL6853483

C[C@@]1(c2ccc(O)cc2)NC(=O)Nc2ccc(Cl)cc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE7A Q13946 2/20 0.48
AKR1B1 P15121 6/20 0.45
HTR6 P50406 1/20 0.41
IDO1 P14902 2/20 0.41
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
PSEN1 P49768 1/20 0.39
PSEN2 P49810 1/20 0.39
APH1B Q8WW43 1/20 0.39
NCSTN Q92542 1/20 0.39
APH1A Q96BI3 1/20 0.39
PSENEN Q9NZ42 1/20 0.39
LRRK2 Q5S007 1/20 0.39
AKR1A1 P14550 1/20 0.39
PGR P06401 2/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36

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
SCHEMBL8471852 1.00 PDE7A (0.48) PDE7AAKR1B1HTR6IDO1MMP2
SCHEMBL1408090 1.00 PDE7A (0.48) PDE7AAKR1B1HTR6IDO1MMP2
SCHEMBL21940203 0.86 PDE7A (0.50) PDE7AAKR1B1HTR6IDO1AKR1A1
SCHEMBL6853497 0.83 MMP2 (0.40) PDE7AAKR1B1HTR6MMP2MMP9
SCHEMBL6853499 0.76 PDE7A (0.46) PDE7AAKR1B1IDO1AKR1A1PGR
SCHEMBL5479245 0.74 CHRM2 (0.62) PDE7AAKR1B1HTR6IDO1PSEN1
SCHEMBL21939601 0.70 IDO1 (0.40) PDE7AAKR1B1HTR6IDO1MMP2
SCHEMBL21939542 0.70 AKR1B1 (0.46) PDE7AAKR1B1MMP2MMP9LRRK2
SCHEMBL19605042 0.70 AKR1B1 (0.46) PDE7AAKR1B1MMP2MMP9LRRK2
SCHEMBL542817 0.69 LMNA (0.51) AKR1B1HTR6MMP2MMP9AKR1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9872858-B2 Treatment of degenerations and light-induced damage to the retina BIOCODEX (FR) 2018-01-23 US disclosed
US-9872858-B2 Treatment of degenerations and light-induced damage to the retina BIOCODEX (FR) 2018-01-23 US disclosed
US-20170000798-A1 TREATMENT OF DEGENERATIONS AND LIGHT-INDUCED DAMAGE TO THE RETINA BIOCODEX (FR) 2017-01-05 US disclosed
US-20170000798-A1 TREATMENT OF DEGENERATIONS AND LIGHT-INDUCED DAMAGE TO THE RETINA BIOCODEX (FR) 2017-01-05 US disclosed
US-8338410-B2 Neuroprotective compounds and pharmaceutical compositions comprising them BIOCODEX (FR) 2012-12-25 US disclosed
US-8338410-B2 Neuroprotective compounds and pharmaceutical compositions comprising them BIOCODEX (FR) 2012-12-25 US disclosed
WO-2012120423-A1 PHARMACEUTICAL COMPOSITION FOR THE PREVENTION OR TREATMENT OF CANCERS BIOCODEX (FR) 2012-09-13 WO disclosed
EP-1745785-B1 Pharmaceutical composition for preventing or treating cerebral oedema BIOCODEX (FR) 2011-03-09 EP disclosed
US-20090298817-A1 ANTI-AMNESIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM BIOCODEX (FR) 2009-12-03 US disclosed
US-20090298817-A1 ANTI-AMNESIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM BIOCODEX (FR) 2009-12-03 US disclosed
US-7569565-B2 Etifoxine derivatives; corticoids; methyl-d-aspartic acid antagonists BIOCODEX (FR) 2009-08-04 US disclosed
US-7569565-B2 Etifoxine derivatives; corticoids; methyl-d-aspartic acid antagonists BIOCODEX (FR) 2009-08-04 US disclosed
US-20070167446-A1 Neuroprotective compounds and pharmaceutical compositions comprising them BIOCODEX (FR) 2007-07-19 US disclosed
US-20070167446-A1 Neuroprotective compounds and pharmaceutical compositions comprising them BIOCODEX (FR) 2007-07-19 US disclosed
US-20070021415-A1 Pharmaceutical composition for the prevention or treatment of cerebral oedemas BIOCODEX (FR) 2007-01-25 US disclosed
US-20070021415-A1 Pharmaceutical composition for the prevention or treatment of cerebral oedemas BIOCODEX (FR) 2007-01-25 US disclosed
EP-1745786-A1 Neuroprotective compounds and pharmaceutical compositions comprising them Biocodex (FR) 2007-01-24 EP disclosed
EP-1745785-A1 Pharmaceutical composition for preventing or treating cerebral oedema Biocodex (FR) 2007-01-24 EP 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 (4 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-20070167446-A1 Neuroprotective compounds and pharmaceutical compositions comprising them BDNF, NLN, GAP43 PDE7A 3109/4885AKR1B1 1998/4885HTR6 613/4885
US-20170000798-A1 TREATMENT OF DEGENERATIONS AND LIGHT-INDUCED DAMAGE TO THE RETINA ALDH1A2, ALDH1A3, PDE6D PDE7A 1432/4885AKR1B1 635/4885HTR6 3808/4885
US-20090298817-A1 ANTI-AMNESIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM GRIK5, GRIN2C, GRIN3B PDE7A 663/4885AKR1B1 1928/4885HTR6 296/4885
US-20070021415-A1 Pharmaceutical composition for the prevention or treatment of cerebral oedemas AQP4, AQP1, AQP3 PDE7A 913/4885AKR1B1 849/4885HTR6 1208/4885

“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.