SCHEMBL20190138

SCHEMBL20190138

Cc1cc(OC(F)(F)F)ccc1-c1cnc2nccn2c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 1/20 0.47
GRM5 P41594 10/20 0.46
CYP1A2 P05177 3/20 0.46
DYRK1A Q13627 1/20 0.44
KDM4E B2RXH2 1/20 0.44
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
RAB9A P51151 1/20 0.44
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
NAMPT P43490 1/20 0.39
MCHR1 Q99705 1/20 0.39
PDE2A O00408 1/20 0.38
PDE7A Q13946 1/20 0.38
PDE11A Q9HCR9 1/20 0.38
PDE10A Q9Y233 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
SCHEMBL20191067 0.83 CYP1A2 (0.50) GRM5CYP1A2DYRK1AKDM4ENPC1
SCHEMBL16474641 0.82 KDM4E (0.40) GRM5CYP1A2DYRK1AKDM4ENPC1
SCHEMBL20208549 0.81 DYRK1A (0.59) SCN5AGRM5DYRK1AKDM4ENPC1
SCHEMBL20190955 0.79 SCN5A (0.56) SCN5AGRM5CYP1A2MAOAMAOB
SCHEMBL20190231 0.79 SCN5A (0.53) SCN5AGRM5CYP1A2MAOAMAOB
SCHEMBL23572552 0.76 SCN5A (0.53) SCN5AGRM5CYP1A2MAOAMAOB
SCHEMBL20188635 0.74 SCN5A (0.49) SCN5ACYP1A2MAOAMAOBPDE2A
SCHEMBL30639468 0.74 DYRK1A (0.55) GRM5DYRK1AKDM4ENPC1ALDH1A1
SCHEMBL17174332 0.70 NPC1 (0.38) SCN5AGRM5CYP1A2KDM4ENPC1
SCHEMBL18077715 0.70 GRM5 (0.40) GRM5CYP1A2DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210188839-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. 2021-06-24 US disclosed
US-20210188839-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. 2021-06-24 US disclosed
WO-2018098500-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. (US) 2018-05-31 WO disclosed
WO-2018098500-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. (US) 2018-05-31 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 (1 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-20210188839-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B SCN5A 8/4885GRM5 179/4885CYP1A2 1988/4885

“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.