SCHEMBL20203750

SCHEMBL20203750

FC(F)Oc1ccc(-c2ccc3nnc(C(F)(F)F)n3n2)cc1

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 9/20 0.71
SCN5A Q14524 4/20 0.71
ALDH1A1 P00352 2/20 0.50
HTT P42858 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
SCN1A P35498 1/20 0.42
SCN2A Q99250 1/20 0.42
ALOX15 P16050 1/20 0.41
MET P08581 1/20 0.41

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
SCHEMBL26539289 0.90 CYP1A2 (0.57) CYP1A2SCN5AALDH1A1MET
SCHEMBL937201 0.83 CYP1A2 (1.00) CYP1A2SCN5AALDH1A1HTTTDP1
SCHEMBL938928 0.81 CYP1A2 (0.71) CYP1A2SCN5AALDH1A1HTTTDP1
SCHEMBL26538901 0.81 CYP1A2 (0.80) CYP1A2SCN5AALDH1A1HTTTDP1
SCHEMBL937299 0.80 CYP1A2 (0.70) CYP1A2SCN5AALDH1A1HTTTDP1
SCHEMBL20203714 0.80 CYP1A2 (0.69) CYP1A2SCN5AALDH1A1HTTTDP1
SCHEMBL11397300 0.80 CYP1A2 (0.69) CYP1A2SCN5AALDH1A1HTTTDP1
SCHEMBL12909169 0.79 CYP1A2 (0.68) CYP1A2SCN5AALDH1A1HTTTDP1
SCHEMBL20203936 0.79 CYP1A2 (0.68) CYP1A2SCN5AALDH1A1HTTTDP1
SCHEMBL937323 0.77 SCN5A (1.00) CYP1A2SCN5ASCN1ASCN2A

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-20230322790-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. 2023-10-12 US disclosed
US-20230322790-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. 2023-10-12 US disclosed
US-20210188852-A1 COMPOUNDS AND THEIR METHODS OF USE PRAXIS PRECISION MEDICINES, INC. 2021-06-24 US disclosed
WO-2018098499-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 (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-20210188852-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B CYP1A2 1988/4885SCN5A 8/4885ALDH1A1 916/4885
US-20230322790-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B CYP1A2 1988/4885SCN5A 8/4885ALDH1A1 916/4885

“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.