SCHEMBL562870

SCHEMBL562870

O=C(NC1CCC2(CC1)CC2)OCc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.68
GAA P10253 1/20 0.68
TSHR P16473 1/20 0.65
EPHX1 P07099 1/20 0.61
KDM1A O60341 1/20 0.58
MAOB P27338 1/20 0.58
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
CTSL P07711 1/20 0.55
CTSB P07858 1/20 0.55
CTSK P43235 1/20 0.55
DPP4 P27487 4/20 0.53
DPP7 Q9UHL4 4/20 0.53
KCNH2 Q12809 2/20 0.53
CPB1 P15086 1/20 0.52
TLR4 O00206 1/20 0.51
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
ACHE P22303 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
Hydrochloric Acid SCHEMBL30121243 0.90 ALDH1A1 (0.60) ALDH1A1GAATSHREPHX1KDM1A
SCHEMBL31020422 0.89 ALDH1A1 (0.62) ALDH1A1GAATSHREPHX1KDM1A
Hydrochloric Acid SCHEMBL30121142 0.88 ALDH1A1 (0.61) ALDH1A1GAATSHREPHX1KDM1A
SCHEMBL3948461 0.88 ALDH1A1 (0.85) ALDH1A1GAATSHREPHX1KDM1A
SCHEMBL3948456 0.88 ALDH1A1 (0.85) ALDH1A1GAATSHREPHX1KDM1A
SCHEMBL381922 0.88 ALDH1A1 (0.85) ALDH1A1GAATSHREPHX1KDM1A
SCHEMBL28001597 0.87 ALDH1A1 (0.67) ALDH1A1GAATSHREPHX1KDM1A
SCHEMBL25568205 0.87 ALDH1A1 (0.67) ALDH1A1GAATSHREPHX1KDM1A
SCHEMBL30121373 0.87 ALDH1A1 (0.60) ALDH1A1GAATSHREPHX1KDM1A
Hydrochloric Acid SCHEMBL28135182 0.86 ALDH1A1 (0.83) ALDH1A1GAATSHREPHX1KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2154970-B1 DI-SUBSTITUTED AMIDES FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES RESPIRERX PHARMACEUTICALS INC (US) 2017-10-25 EP disclosed
US-8642633-B2 Di-substituted amides for enhancing glutamatergic synaptic responses CORTEX PHARMACEUTICALS, INC. (US) 2014-02-04 US disclosed
US-20130137733-A1 Di-Substituted Amides for Enhancing Glutamatergic Synaptic Responses CORTEX PHARMACEUTICALS, INC. (US) 2013-05-30 US disclosed
US-8404682-B2 Di-substituted amides for enhancing glutamatergic synaptic responses CORTEX PHARMACEUTICALS, INC. (US) 2013-03-26 US disclosed
US-20120035173-A1 DI-SUBSTITUTED AMIDES FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES RESPIRERX PHARMACEUTICALS INC 2012-02-09 US disclosed
US-8013003-B2 Di-substituted amides for enhancing glutamatergic synaptic responses CORTEX PHARMACEUTICALS, INC. (US) 2011-09-06 US disclosed
US-20100120764-A1 DI-SUBSTITUTED AMIDES FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES RESPIRERX PHARMACEUTICALS INC 2010-05-13 US disclosed
EP-2154970-A1 DI-SUBSTITUTED AMIDES FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES CORTEX PHARMACEUTICALS, INC. (US) 2010-02-24 EP disclosed
WO-2008143963-A1 DI-SUBSTITUTED AMIDES FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES CORTEX PHARMACEUTICALS, INC. (US) 2008-11-27 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 (3 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-20120035173-A1 DI-SUBSTITUTED AMIDES FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES GRIN2A, GRIN2B, SLC18A2 ALDH1A1 1891/4885GAA 256/4885TSHR 2042/4885
US-20100120764-A1 DI-SUBSTITUTED AMIDES FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES DRD2, DRD3, GAP43 ALDH1A1 1189/4885GAA 481/4885TSHR 1195/4885
US-20130137733-A1 Di-Substituted Amides for Enhancing Glutamatergic Synaptic Responses DRD2, DRD3, GAP43 ALDH1A1 1189/4885GAA 481/4885TSHR 1195/4885

“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.