SCHEMBL1433337

SCHEMBL1433337

O=C(NCc1ccccn1)c1cc(OCC(F)(F)F)ccc1OCC(F)(F)F

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.63
▸ KDM4E B2RXH2 1/20 0.61
▸ SMN1; SMN2 Q16637 3/20 0.59
▸ MAPK1 P28482 1/20 0.59
▸ CYP1A2 P05177 2/20 0.58
▸ CYP2C9 P11712 2/20 0.58
▸ NPSR1 Q6W5P4 1/20 0.57
▸ RAB9A P51151 1/20 0.57
▸ POLB P06746 2/20 0.56
▸ SORT1 Q99523 1/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ HTT P42858 3/20 0.54
▸ LMNA P02545 2/20 0.54
▸ CYP3A4 P08684 1/20 0.54
▸ CYP2D6 P10635 1/20 0.54
▸ CYP2C19 P33261 1/20 0.54
▸ MAPT P10636 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ XBP1 P17861 1/20 0.53

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
SCHEMBL31390541 1.00 ALDH1A1 (0.63) ALDH1A1KDM4ESMN1; SMN2MAPK1CYP1A2
SCHEMBL10470169 0.94 RAB9A (0.59) ALDH1A1KDM4ESMN1; SMN2MAPK1CYP1A2
SCHEMBL10469568 0.94 ALDH1A1 (0.58) ALDH1A1KDM4ESMN1; SMN2MAPK1CYP1A2
SCHEMBL10469211 0.93 ALDH1A1 (0.55) ALDH1A1KDM4ESMN1; SMN2MAPK1CYP1A2
SCHEMBL10470174 0.92 KMT2A (0.68) ALDH1A1KDM4ESMN1; SMN2MAPK1CYP1A2
SCHEMBL11108904 0.92 KMT2A (0.66) ALDH1A1KDM4ESMN1; SMN2MAPK1CYP1A2
SCHEMBL10469152 0.92 ALDH1A1 (0.54) ALDH1A1KDM4ESMN1; SMN2MAPK1CYP1A2
SCHEMBL10469519 0.92 ALDH1A1 (0.56) ALDH1A1KDM4ESMN1; SMN2MAPK1CYP1A2
SCHEMBL10469507 0.92 ALDH1A1 (0.56) ALDH1A1KDM4ESMN1; SMN2MAPK1CYP1A2
SCHEMBL10469524 0.92 HPGD (0.61) ALDH1A1KDM4ESMN1; SMN2MAPK1CYP1A2

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
EP-1907360-B1 IMPROVED PROCESS FOR THE MANUFACTURE OF FLECAINIDE GLADE ORGANICS PRIVATE LTD (IN) 2011-03-30 — — EP claimed
US-20100184990-A1 Process for the Manufacture of Flecainide GLADE ORGANICS PRIVATE LIMITED (IN) 2010-07-22 — — US claimed
US-20100056794-A1 PROCESS FOR THE PREPARATION OF 2,5-BIS-(2,2,2-TRIFLUOROETHOXY)-N-(2-PIPERIDYL-METHYL)-BENZAMIDE AND SALTS THEREOF GRINDEKS A JOINT STOCK COMPANY (LV) 2010-03-04 — — US claimed
EP-1907360-A4 IMPROVED PROCESS FOR THE MANUFACTURE OF FLECAINIDE GLADE ORGANICS PRIVATE LTD (IN) 2009-04-01 — — EP claimed
EP-1918280-A1 Process for the preparation of 2,5-bis-(2,2,2-trifluoroethoxy)-N-(2-piperidylmethyl)-benzamide and salts thereof "Joint Stock Company Grindeks" (LV) 2008-05-07 — — EP claimed
EP-1907360-A1 IMPROVED PROCESS FOR THE MANUFACTURE OF FLECAINIDE Glade Organics Private Limited (IN) 2008-04-09 — — EP claimed
WO-2007003982-A1 IMPROVED PROCESS FOR THE MANUFACTURE OF FLECAINIDE GLADE ORGANICS PRIVATE LIMITED (IN) 2007-01-11 — — WO claimed
US-6586598-B2 Reacting 2,5-bis(2,2,2- trifluoroethoxy)- alpha , alpha -dibromo- alpha -chloro acetophenone with 2-(aminomethyl)pyridine to form 2,5-bis(2,2,2-trifluoroethoxy)-N-(2-pyridylmethyl)-benzamide, and reducing GENEVA PHARMACEUTICALS, INC. 2003-07-01 — — US claimed
EP-1303489-A2 ALPHA,ALPHA-DIBROMO-ALPHA-CHLORO-ACETOPHENONES AS SYNTHONS GENEVA PHARMACEUTICALS, INC. (US) 2003-04-23 — — EP claimed
US-20020188130-A1 Alpha, alpha-dibromo-alpha-chloro-acetophenones as synthons RAY ANUP K (US) 2002-12-12 — — US claimed
US-6458957-B1 PROCESS FOR PREPARING AN AROMATIC CARBONYL COMPOUND, WHICH COMPRISES (A) CONVERTING AN .ALPHA.-CHLORO DERIVATIVE OF AN ACETOPHENONE COMPOUND TO DIBROMO-.ALPHA.-CHLORO ACETOPHENONE COMPOUND AND (B) REACTING THE GENEVA PHARMACEUTICALS, INC. 2002-10-01 — — US claimed
WO-2002004419-A2 α,α-DIBROMO-α-CHLORO-ACETOPHENONES AS SYNTHONS GENEVA PHARMACEUTICALS, INC. (US) 2002-01-17 — — WO claimed
US-4684733-A Process for the preparation of intermediates of derivatives of pyrrolidine and piperidine RIKER LABORATORIES, INC. (US) 1987-08-04 — — US claimed
US-4650873-A Process for the preparation of a derivative of piperidine RIKER LABORATORIES (US) 1987-03-17 — — US claimed
US-4617396-A Process for the preparation of derivatives of piperidine RIKER LABORATORIES, INC. (US) 1986-10-14 — — US claimed
EP-2079674-B1 PROCESS FOR THE PREPARATION OF TRIFLUOROETHOXYTOLUENES GRINDEKS JSC (LV) 2011-06-29 — — EP disclosed
EP-1907360-B1 IMPROVED PROCESS FOR THE MANUFACTURE OF FLECAINIDE GLADE ORGANICS PRIVATE LTD (IN) 2011-03-30 — — EP disclosed
US-4617396-A Process for the preparation of derivatives of piperidine RIKER LABORATORIES, INC. (US) 1986-10-14 — — US disclosed
US-4013670-A ANTIARRHYTHMICS RIKER LABORATORIES, INC. (US) 1977-03-22 — — US disclosed
US-4005209-A Antiarrhythmic method utilizing fluoroalkoxy-N-piperidyl and pyridyl benzamides RIKER LABORATORIES, INC. (US) 1977-01-25 — — 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 (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-20100056794-A1 PROCESS FOR THE PREPARATION OF 2,5-BIS-(2,2,2-TRIFLUOROETHOXY)-N-(2-PIPERIDYL-METHYL)-BENZAMIDE AND SALTS THEREOF BOLA2; BOLA2B, TET2, CYP1A2 ALDH1A1 430/4885KDM4E 429/4885SMN1; SMN2 1097/4885
US-20020188130-A1 Alpha, alpha-dibromo-alpha-chloro-acetophenones as synthons CYP2D6, CYP2B6, CYP2A6 ALDH1A1 251/4885KDM4E 3023/4885SMN1; SMN2 1852/4885
US-20100184990-A1 Process for the Manufacture of Flecainide KCND2, KCNH1, KCNH2 ALDH1A1 960/4885KDM4E 478/4885SMN1; SMN2 1980/4885

“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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