SCHEMBL3132030

SCHEMBL3132030

CN(C)C(=O)Cc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.83

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 10/20 0.83
▸ LTB4R Q15722 1/20 0.72
▸ LTB4R2 Q9NPC1 1/20 0.72
▸ PTGS1 P23219 1/20 0.58
▸ PTGS2 P35354 1/20 0.58
▸ MAOB P27338 1/20 0.58
▸ L3MBTL1 Q9Y468 1/20 0.57
▸ NR4A1 P22736 1/20 0.57
▸ NR4A2 P43354 1/20 0.57
▸ NR4A3 Q92570 1/20 0.57
▸ FFAR1 O14842 1/20 0.56
▸ FFAR4 Q5NUL3 1/20 0.56

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
SCHEMBL2755055 0.91 ALOX5 (1.00) ALOX5LTB4RLTB4R2PTGS1PTGS2
SCHEMBL8652025 0.87 ALOX5 (0.76) ALOX5LTB4RLTB4R2PTGS1PTGS2
SCHEMBL2353230 0.87 ALOX5 (0.76) ALOX5LTB4RLTB4R2PTGS1PTGS2
SCHEMBL1957356 0.86 SMN1; SMN2 (0.71) ALOX5LTB4RLTB4R2PTGS1PTGS2
SCHEMBL8387473 0.85 ALOX5 (0.74) ALOX5LTB4RLTB4R2PTGS1PTGS2
SCHEMBL339507 0.83 CES2 (0.56) ALOX5LTB4RLTB4R2
Iodomethane SCHEMBL8389381 0.82 ALOX5 (0.70) ALOX5LTB4RLTB4R2PTGS1PTGS2
SCHEMBL10691196 0.82 ALOX5 (0.74) ALOX5LTB4RLTB4R2PTGS1PTGS2
SCHEMBL68570 0.82 ALOX5 (0.69) ALOX5LTB4RLTB4R2PTGS1PTGS2
SCHEMBL10048247 0.82 SMN1; SMN2 (0.66) ALOX5LTB4RLTB4R2FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101597238-A N, the preparation method of N-dimethyl-4-benzyloxy phenyl acetamide FANPING CAI (CN) 2009-12-09 — — CN claimed
CN-101223129-A Highly selective serotonin and norepinephrine dual reuptake inhibitor and use thereof WYETH CORP (US) 2008-07-16 — — CN claimed
EP-1904434-A2 HIGHLY SELECTIVE SEROTONIN AND NOREPINEPHRINE DUAL REUPTAKE INHIBITOR AND USE THEREOF Wyeth a Corporation of the State of Delaware (US) 2008-04-02 — — EP claimed
WO-2007011594-A2 HIGHLY SELECTIVE SEROTONIN AND NOREPINEPHRINE DUAL REUPTAKE INHIBITOR AND USE THEREOF WYETH (US) 2007-01-25 — — WO claimed
US-20070015828-A1 Highly selective serotonin and norepinephrine dual reuptake inhibitor and use thereof WYETH (US) 2007-01-18 — — US claimed
US-20160355457-A1 Solid Forms Comprising(-)-O-Desmethylvenlafaxine And Uses Thereof SUNOVION PHARMACEUTICALS INC. 2016-12-08 — — US disclosed
EP-2114863-B1 SOLID FORMS COMPRISING (-)-O-DESMETHYLVENLAFAXINE AND USES THEREOF SEPRACOR INC (US) 2016-10-05 — — EP disclosed
US-20150183722-A1 Process for the Preparation of O-Desmethyl Venlafaxine and Intermediate for Use Therein CIPLA LIMITED (IN) 2015-07-02 — — US disclosed
US-20150183722-A1 Process for the Preparation of O-Desmethyl Venlafaxine and Intermediate for Use Therein CIPLA LIMITED (IN) 2015-07-02 — — US disclosed
US-9012689-B2 Process for the preparation of O-desmethyl venlafaxine and intermediate for use therein CIPLA LIMITED (IN) 2015-04-21 — — US disclosed
US-9012689-B2 Process for the preparation of O-desmethyl venlafaxine and intermediate for use therein CIPLA LIMITED (IN) 2015-04-21 — — US disclosed
EP-2500337-A2 Solid form comprising (-) o-desmethylvenlafaxine and uses thereof Sepracor Inc. (US) 2012-09-19 — — EP disclosed
US-20070015828-A1 Highly selective serotonin and norepinephrine dual reuptake inhibitor and use thereof WYETH (US) 2007-01-18 — — US disclosed
US-20070015828-A1 Highly selective serotonin and norepinephrine dual reuptake inhibitor and use thereof WYETH (US) 2007-01-18 — — US disclosed
US-20070015828-A1 Highly selective serotonin and norepinephrine dual reuptake inhibitor and use thereof WYETH (US) 2007-01-18 — — US disclosed
US-20070015791-A1 Serotonin and norepinephrine reuptake inhibitors and uses thereof WYETH (US) 2007-01-18 — — US disclosed
US-20070015791-A1 Serotonin and norepinephrine reuptake inhibitors and uses thereof WYETH (US) 2007-01-18 — — US disclosed
US-20070015791-A1 Serotonin and norepinephrine reuptake inhibitors and uses thereof WYETH (US) 2007-01-18 — — US disclosed
US-20070015824-A1 Serotonin and norepinephrine reuptake inhibitor and uses thereof WYETH (US) 2007-01-18 — — US disclosed
US-20070015824-A1 Serotonin and norepinephrine reuptake inhibitor and uses thereof WYETH (US) 2007-01-18 — — US 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 (5 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-20070015828-A1 Highly selective serotonin and norepinephrine dual reuptake inhibitor and use thereof SLC6A2, SLC6A3, SLC6A4 ALOX5 2019/4885LTB4R 2928/4885LTB4R2 2941/4885
US-20150183722-A1 Process for the Preparation of O-Desmethyl Venlafaxine and Intermediate for Use Therein SLC6A2, SLC6A3, MAOA ALOX5 1190/4885LTB4R 4077/4885LTB4R2 4065/4885
US-20160355457-A1 Solid Forms Comprising(-)-O-Desmethylvenlafaxine And Uses Thereof COMT, SLC6A3, SLC6A2 ALOX5 1567/4885LTB4R 4644/4885LTB4R2 4581/4885
US-20070015791-A1 Serotonin and norepinephrine reuptake inhibitors and uses thereof SLC6A2, SLC6A3, SLC6A4 ALOX5 1659/4885LTB4R 2574/4885LTB4R2 2791/4885
US-20070015824-A1 Serotonin and norepinephrine reuptake inhibitor and uses thereof SLC6A2, SLC6A3, SLC6A4 ALOX5 1872/4885LTB4R 2784/4885LTB4R2 3018/4885

“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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