SCHEMBL2933337

SCHEMBL2933337

C[C@H](CNS(C)(=O)=O)NCc1ccc(OCc2ccccc2F)c(Cc2ccccc2F)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.44
SCN9A Q15858 1/20 0.43
KMT2A Q03164 5/20 0.40
MEN1 O00255 4/20 0.40
HTT P42858 2/20 0.40
PKM P14618 2/20 0.40
RAB9A P51151 1/20 0.40
MAPT P10636 5/20 0.40
GAA P10253 3/20 0.40
SMN1; SMN2 Q16637 4/20 0.39
LMNA P02545 3/20 0.39
NPSR1 Q6W5P4 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
CD274 Q9NZQ7 2/20 0.39
KDM4E B2RXH2 2/20 0.39
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL2934213 1.00 MCL1 (0.44) MCL1SCN9AKMT2AMEN1HTT
SCHEMBL2939300 1.00 MCL1 (0.44) MCL1SCN9AKMT2AMEN1HTT
SCHEMBL3773472 0.91 MCL1 (0.40) MCL1SCN9AKMT2AMEN1HTT
SCHEMBL1697251 0.83 SCN9A (0.61) SCN9AKMT2ARAB9ALMNAKDM4E
SCHEMBL1697243 0.83 SCN9A (0.61) SCN9AKMT2ARAB9ALMNAKDM4E
SCHEMBL1697231 0.83 SCN9A (0.61) SCN9AKMT2ARAB9ALMNAKDM4E
SCHEMBL2933340 0.82 SCN9A (0.65) MCL1SCN9AKMT2AHTTRAB9A
SCHEMBL2939556 0.82 MAOB (0.44) SCN9AMAPTGAALMNAKDM4E
SCHEMBL2933335 0.82 SCN9A (0.65) MCL1SCN9AKMT2AHTTRAB9A
SCHEMBL2938204 0.82 MAOB (0.44) SCN9AMAPTGAALMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3257842-B1 THERAPEUTIC USE OF 2-[4-(3- OR 2-FLUOROBENZYLOXY)BENZYLAMINO]PROPANAMIDES WITH HIGH PURITY DEGREE NEWRON PHARM SPA (IT) 2020-11-18 EP disclosed
CN-104523668-B High-purity 2- [4- (3-or 2-fluorobenzyloxy) benzylamino ] propanamides and use thereof 纽朗制药有限公司 2020-06-09 CN disclosed
EP-3257842-A1 PROCESS FOR THE PRODUCTION OF 2-[4-(3- OR 2-FLUOROBENZYLOXY)BENZYLAMINO]PROPANAMIDES WITH HIGH PURITY DEGREE Newron Pharmaceuticals S.p.A. (IT) 2017-12-20 EP disclosed
EP-2229351-B1 PROCESS FOR THE PRODUCTION OF 2-[4-(3- OR 2-FLUOROBENZYLOXY)BENZYLAMINO]PROPANAMIDES WITH HIGH PURITY DEGREE NEWRON PHARM SPA (IT) 2017-11-08 EP disclosed
US-8846763-B2 High purity 2-[4-(3- or 2-fluorobenzyloxy)benzylamino] propanamides and methods of use thereof NEWRON PHARMACEUTICALS, S.P.A. (IT) 2014-09-30 US disclosed
US-20140051758-A1 HIGH PURITY 2-[4-(3- OR 2-FLUOROBENZYLOXY)BENZYLAMINO] PROPANAMIDES AND METHODS OF USE THEREOF NEWRON PHARMACEUTICALS S.P.A. (IT) 2014-02-20 US disclosed
US-8530701-B2 High purity 2-[4-(3- OR 2-fluorobenzyloxy)benzylamino]propanamides and methods of use thereof NEWRON PHARMACEUTICALS, S.P.A. (IT) 2013-09-10 US disclosed
US-20100324141-A1 HIGH PURITY 2-[4-(3- OR 2-FLUOROBENZYLOXY)BENZYLAMINO]PROPANAMIDES AND METHODS OF USE THEREOF NEWRON PHARMACEUTICALS S.P.A. (IT) 2010-12-23 US disclosed
EP-2229351-A1 PROCESS FOR THE PRODUCTION OF 2-Ý4-(3- OR 2-FLUOROBENZYLOXY)BENZYLAMINO¨PROPANAMIDES WITH HIGH PURITY DEGREE Newron Pharmaceuticals S.p.A. (IT) 2010-09-22 EP disclosed
WO-2009074478-A1 PROCESS FOR THE PRODUCTION OF 2-[4-(3- OR 2-FLUOROBENZYLOXY)BENZYLAMINO]PROPANAMIDES WITH HIGH PURITY DEGREE NEWRON PHARMACEUTICALS S.P.A. (IT) 2009-06-18 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 (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-20140051758-A1 HIGH PURITY 2-[4-(3- OR 2-FLUOROBENZYLOXY)BENZYLAMINO] PROPANAMIDES AND METHODS OF USE THEREOF KCNH3, KCNB2, KCNH2 MCL1 1358/4885SCN9A 146/4885KMT2A 482/4885
US-20100324141-A1 HIGH PURITY 2-[4-(3- OR 2-FLUOROBENZYLOXY)BENZYLAMINO]PROPANAMIDES AND METHODS OF USE THEREOF PDE7A, PDE8B, PDE9A MCL1 1260/4885SCN9A 147/4885KMT2A 575/4885

“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.