SCHEMBL561952

SCHEMBL561952

CN(C(=O)c1ccc2nonc2c1)c1cccnc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.52
KDM4E B2RXH2 2/20 0.43
KMT2A Q03164 1/20 0.43
MLYCD O95822 1/20 0.42
NOTUM Q6P988 1/20 0.42
POLQ O75417 1/20 0.41
ADORA3 P0DMS8 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA2B P29275 1/20 0.40
ADORA1 P30542 1/20 0.40
GRIA3 P42263 1/20 0.39
GRIA4 P48058 1/20 0.39
HTT P42858 3/20 0.39
ALDH1A1 P00352 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALOX12 P18054 1/20 0.39
CYP2C19 P33261 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
NAMPT P43490 1/20 0.39

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
SCHEMBL562695 0.85 KMT2A (0.53) KDM4EKMT2AADORA3ADORA2AADORA2B
SCHEMBL2791220 0.81 NAMPT (0.47) TRPV1ALDH1A1CYP3A4CYP2C9NAMPT
SCHEMBL13095766 0.79 TRPV1 (0.56) TRPV1KDM4EKMT2AMLYCDNOTUM
SCHEMBL13095850 0.79 TRPV1 (0.56) TRPV1KDM4EKMT2AMLYCDNOTUM
SCHEMBL6237453 0.76 KDM4E (0.68) TRPV1KDM4EKMT2AMLYCDNOTUM
SCHEMBL12978273 0.76 CTNNB1 (0.57) TRPV1KDM4EKMT2AALDH1A1NPC1
SCHEMBL2897595 0.75 TRPV1 (0.53) TRPV1KDM4EKMT2AMLYCDNOTUM
SCHEMBL12978266 0.75 ALDH1A1 (0.57) TRPV1KDM4EKMT2AALDH1A1CYP3A4
SCHEMBL96022 0.75 TRPV1 (0.62) TRPV1KDM4EKMT2AMLYCDNOTUM
SCHEMBL7377948 0.75 TRPV1 (0.62) TRPV1KDM4EKMT2AMLYCDNOTUM

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 44 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240300931-A1 Composition and Methods for Treating Attention Deficit Disorders LIPPA ARNOLD STAN (US) 2024-09-12 US claimed
US-20240100023-A1 Compositions and Methods For Treating Spinal Cord Injuries LIPPA ARNOLD S (US) 2024-03-28 US claimed
US-20230373982-A1 Compositions And Methods For Treating Attention Deficit Disorders LIPPA ARNOLD STAN (US) 2023-11-23 US claimed
US-20230129330-A1 Compositions And Methods For Treating Attention Deficit Disorders LIPPA ARNOLD STAN (US) 2023-04-27 US claimed
US-20210340130-A1 Compositions and methods for treating attention deficit disorders LIPPA ARNOLD STAN (US) 2021-11-04 US claimed
US-20190112300-A1 Compositions And Methods For Treating Attention Deficit Disorders LIPPA ARNOLD STAN (US) 2019-04-18 US claimed
EP-2154970-B1 DI-SUBSTITUTED AMIDES FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES RESPIRERX PHARMACEUTICALS INC (US) 2017-10-25 EP claimed
US-8404682-B2 Di-substituted amides for enhancing glutamatergic synaptic responses CORTEX PHARMACEUTICALS, INC. (US) 2013-03-26 US claimed
US-20120035173-A1 DI-SUBSTITUTED AMIDES FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES RESPIRERX PHARMACEUTICALS INC 2012-02-09 US claimed
US-8013003-B2 Di-substituted amides for enhancing glutamatergic synaptic responses CORTEX PHARMACEUTICALS, INC. (US) 2011-09-06 US claimed
US-20100120764-A1 DI-SUBSTITUTED AMIDES FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES RESPIRERX PHARMACEUTICALS INC 2010-05-13 US claimed
US-20240355686-A1 Clinical Methods and Pharmaceutical Compositions Employing AMPA Receptor Antagonists to Treat Glioblastoma and Other Cancers RADIN DANIEL PIERCE (US) 2024-10-24 US disclosed
US-20240300931-A1 Composition and Methods for Treating Attention Deficit Disorders LIPPA ARNOLD STAN (US) 2024-09-12 US disclosed
US-20240100023-A1 Compositions and Methods For Treating Spinal Cord Injuries LIPPA ARNOLD S (US) 2024-03-28 US disclosed
US-20230373982-A1 Compositions And Methods For Treating Attention Deficit Disorders LIPPA ARNOLD STAN (US) 2023-11-23 US disclosed
US-20100120764-A1 DI-SUBSTITUTED AMIDES FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES RESPIRERX PHARMACEUTICALS INC 2010-05-13 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
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 (8 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-20210340130-A1 Compositions and methods for treating attention deficit disorders GRIN2A, GRIN2C, GRM2 TRPV1 3402/4885KDM4E 3925/4885KMT2A 1530/4885
US-20240100023-A1 Compositions and Methods For Treating Spinal Cord Injuries CHAT, NTRK2, GMFG TRPV1 3553/4885KDM4E 4210/4885KMT2A 1985/4885
US-20230129330-A1 Compositions And Methods For Treating Attention Deficit Disorders GRIN2A, GRIN2C, GRM2 TRPV1 3402/4885KDM4E 3925/4885KMT2A 1530/4885
US-20120035173-A1 DI-SUBSTITUTED AMIDES FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES GRIN2A, GRIN2B, SLC18A2 TRPV1 2436/4885KDM4E 1686/4885KMT2A 1571/4885
US-20100120764-A1 DI-SUBSTITUTED AMIDES FOR ENHANCING GLUTAMATERGIC SYNAPTIC RESPONSES DRD2, DRD3, GAP43 TRPV1 915/4885KDM4E 2026/4885KMT2A 1763/4885
US-20230373982-A1 Compositions And Methods For Treating Attention Deficit Disorders GRIN2A, GRIN2C, GRM2 TRPV1 3402/4885KDM4E 3925/4885KMT2A 1530/4885
US-20240300931-A1 Composition and Methods for Treating Attention Deficit Disorders GRIN2A, GRIN2C, NTRK2 TRPV1 3378/4885KDM4E 4047/4885KMT2A 1678/4885
US-20190112300-A1 Compositions And Methods For Treating Attention Deficit Disorders GRIN2A, GRIN2C, GRM2 TRPV1 3402/4885KDM4E 3925/4885KMT2A 1530/4885

“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.