Enazadrem

Enazadrem

SCHEMBL219332

Cc1nc(NCCCCCCc2ccccc2)nc(C)c1O.O=P(O)(O)O

nearest known ligand 0.87

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Enazadrem. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KCNH3 known ✓ Q9ULD8 1/20 0.43
▸ S1PR2 O95136 1/20 0.49
▸ S1PR4 O95977 1/20 0.49
▸ S1PR1 P21453 1/20 0.49
▸ S1PR3 Q99500 1/20 0.49
▸ ESR2 Q92731 4/20 0.47
▸ ESR1 P03372 3/20 0.47
▸ HPGD P15428 2/20 0.44
▸ SIGMAR1 Q99720 2/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ HTR7 P34969 1/20 0.44
▸ TLR8 Q9NR97 1/20 0.44
▸ TLR7 Q9NYK1 1/20 0.44
▸ FDPS P14324 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43

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
Enazadrem SCHEMBL635505 0.93 ESR1 (0.51) ESR2ESR1HPGDSIGMAR1HTR7
SCHEMBL13932020 0.88 HPGD (0.57) ESR2ESR1HPGDSIGMAR1HTR7
SCHEMBL10503163 0.78 HPGD (0.49) ESR2ESR1HPGDSIGMAR1TLR8
SCHEMBL10503435 0.78 HPGD (0.49) ESR2ESR1HPGDSIGMAR1TLR8
SCHEMBL14215349 0.77 HPGD (0.48) ESR2ESR1HPGDSIGMAR1HTR7
SCHEMBL10367889 0.76 IGF1R (0.42) ESR2ESR1HPGD
SCHEMBL10502861 0.76 HPGD (0.50) ESR2ESR1HPGDSIGMAR1HTR7
SCHEMBL10800127 0.74 P2RX3 (0.48) SIGMAR1
SCHEMBL10367691 0.74 ESR1 (0.50) ESR2ESR1
SCHEMBL10502959 0.72 HPGD (0.55) ESR2ESR1HPGDHTR7TLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150320697-A1 Methods For Bone Treatment By Modulating An Arachidonic Acid Metabolic or Signaling Pathway ACCELALOX, INC. 2015-11-12 — — US claimed
EP-1947942-B1 METHODS FOR BONE TREATMENT BY MODULATING AN ARACHIDONIC ACID METABOLIC OR SIGNALING PATHWAY ACCELALOX INC (US) 2015-07-29 — — EP claimed
US-8980851-B2 Methods for bone treatment by modulating an arachidonic acid metabolic or signaling pathway ACCELALOX, INC. (US) 2015-03-17 — — US claimed
WO-2014031586-A2 METHODS FOR TREATING CARDIOVASCULAR DISEASES TALLIKUT PHARMACEUTICALS, INC. (US) 2014-02-27 — — WO claimed
US-20110124717-A1 Methods for Bone Treatment by Modulating an Arachidonic Acid Metabolic or Signaling Pathway ACCELALOX, INC. (US) 2011-05-26 — — US claimed
US-7829535-B2 for promoting osteogenesis to accelerate or enhance bone fracture healing, treat bone defects, and enhance bone formation are disclosed. The methods modulate an arachidonic acid metabolic or signaling pathway in general, and, in particular, utilize 5-lipoxygenase inhibitors. ACCELALOX, INC. (US) 2010-11-09 — — US claimed
US-20080280826-A1 for promoting osteogenesis to accelerate or enhance bone fracture healing, treat bone defects, and enhance bone formation are disclosed. The methods modulate an arachidonic acid metabolic or signaling pathway in general, and, in particular, utilize 5-lipoxygenase inhibitors. ACCELALOX, INC. (US) 2008-11-13 — — US claimed
CN-101277614-A Methods for bone treatment by modulating an arachidonic acid metabolic or signaling pathway ACCELALOX INC (US) 2008-10-01 — — CN claimed
EP-1947942-A2 METHODS FOR BONE TREATMENT BY MODULATING AN ARACHIDONIC ACID METABOLIC OR SIGNALING PATHWAY Accelalox, Inc. (US) 2008-07-30 — — EP claimed
WO-2007022427-A9 METHODS FOR BONE TREATMENT BY MODULATING AN ARACHIDONIC ACID METABOLIC OR SIGNALING PATHWAY ACCELALOX INC (US) 2007-10-18 — — WO claimed
EP-0833622-B1 COMPOSITIONS COMPRISING A CYCLOOXYGENASE-2 INHIBITOR AND A 5-LIPOXYGENASE INHIBITOR SEARLE & CO (US) 2005-08-10 — — EP claimed
US-20030176421-A1 PROKINETIC AGENTS FOR TREATING GASTRIC HYPOMOTILITY AND RELATED DISORDERS WATSON JOHN W (US) 2003-09-18 — — US claimed
US-20020143033-A1 Immunosuppresive effects of administration of a cyclooxygenase-2 inhibitor and a 5-lipoxygenase inhibitor G.D. SEARLE & CO. 2002-10-03 — — US claimed
US-6376528-B1 SYNERGISTIC MIXTURE G. D. SEARLE & CO. 2002-04-23 — — US claimed
EP-0888127-B1 COMBINATIONS HAVING IMMUNOSUPPRESSIVE EFFECTS, CONTAINING CYCLOOXYGENASE-2-INHIBITORS AND 5-LIPOXYGENASE INHIBITORS SEARLE & CO (US) 2001-12-12 — — EP claimed
US-6136839-A USING A SULFONE OR SULFOAMIDE BENZENE COMPOUND G. D. SEARLE & CO. (US) 2000-10-24 — — US claimed
EP-0888127-A1 COMBINATIONS HAVING IMMUNOSUPPRESSIVE EFFECTS, CONTAINING CYCLOOXYGENASE-2-INHIBITORS AND 5-LIPOXYGENASE INHIBITORS G.D. SEARLE & CO. (US) 1999-01-07 — — EP claimed
EP-0833622-A1 COMPOSITIONS COMPRISING A CYCLOOXYGENASE-2 INHIBITOR AND A 5-LIPOXYGENASE INHIBITOR G.D. SEARLE & CO. (US) 1998-04-08 — — EP claimed
WO-1997029776-A1 COMBINATIONS HAVING IMMUNOSUPPRESSIVE EFFECTS, CONTAINING CYCLOOXYGENASE-2-INHIBITORS AND 5-LIPOXYGENASE INHIBITORS G.D. SEARLE & CO. (US) 1997-08-21 — — WO claimed
WO-1996041626-A1 COMPOSITIONS COMPRISING A CYCLOOXYGENASE-2 INHIBITOR AND A 5-LIPOXYGENASE INHIBITOR G.D. SEARLE & CO. (US) 1996-12-27 — — WO claimed

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-20030176421-A1 PROKINETIC AGENTS FOR TREATING GASTRIC HYPOMOTILITY AND RELATED DISORDERS OPRM1, OPRK1, OPRD1 KCNH3 924/4885S1PR2 4364/4885S1PR4 3277/4885
US-20020143033-A1 Immunosuppresive effects of administration of a cyclooxygenase-2 inhibitor and a 5-lipoxygenase inhibitor ALOX5, ALOX15B, ALOX15 KCNH3 4776/4885S1PR2 488/4885S1PR4 748/4885

“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.

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