SCHEMBL20189522

SCHEMBL20189522

N#CC1(c2ccc(-c3cn4c(C(F)(F)F)cnc4cn3)cc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.50
SCN5A Q14524 1/20 0.39
MKNK1 Q9BUB5 4/20 0.39
MKNK2 Q9HBH9 4/20 0.39
TNF P01375 1/20 0.35
FYN P06241 7/20 0.35
FGFR1 P11362 1/20 0.35
FGFR4 P22455 1/20 0.35

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
SCHEMBL20208533 0.86 SCN5A (0.55) CYP1A2SCN5AMKNK1MKNK2TNF
SCHEMBL20203933 0.83 CYP1A2 (0.64) CYP1A2SCN5A
SCHEMBL20188612 0.82 CYP1A2 (0.42) CYP1A2MKNK1MKNK2FYN
SCHEMBL20209010 0.80 CYP1A2 (0.54) CYP1A2SCN5ATNFFGFR1FGFR4
SCHEMBL20203847 0.80 CYP1A2 (0.59) CYP1A2SCN5AFGFR1FGFR4
SCHEMBL26539127 0.79 CYP1A2 (0.55) CYP1A2SCN5AMKNK1MKNK2FGFR1
SCHEMBL23572493 0.79 CYP1A2 (0.44) CYP1A2SCN5A
SCHEMBL20209245 0.78 CYP1A2 (0.51) CYP1A2SCN5ATNF
SCHEMBL20208584 0.77 MKNK1 (0.51) CYP1A2SCN5AMKNK1MKNK2FYN
SCHEMBL26462170 0.75 CYP1A2 (0.46) CYP1A2FGFR1FGFR4

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 CYP1A2 1988/4885SCN5A 8/4885MKNK1 2955/4885

“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.