SCHEMBL20204041

SCHEMBL20204041

COCc1ccc(-c2cn3c(C(F)F)nnc3cn2)cc1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 5/20 0.47
SCN5A Q14524 1/20 0.40
FYN P06241 8/20 0.39
CHEK1 O14757 3/20 0.37
CHEK2 O96017 2/20 0.37
ABL1 P00519 2/20 0.37
MAPK14 Q16539 1/20 0.37
MKNK1 Q9BUB5 2/20 0.34
MKNK2 Q9HBH9 2/20 0.34

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
SCHEMBL26539405 0.92 CYP1A2 (0.46) CYP1A2SCN5AFYNCHEK1CHEK2
SCHEMBL20203831 0.86 CYP1A2 (0.52) CYP1A2SCN5AFYNCHEK1CHEK2
SCHEMBL23571348 0.86 CYP1A2 (0.52) CYP1A2SCN5AFYNCHEK1CHEK2
SCHEMBL20190997 0.84 FYN (0.49) CYP1A2SCN5AFYNCHEK1CHEK2
SCHEMBL20190957 0.82 MKNK1 (0.50) CYP1A2SCN5AFYNMAPK14MKNK1
SCHEMBL20203911 0.81 CYP1A2 (0.64) CYP1A2SCN5AFYN
SCHEMBL20203724 0.80 CYP1A2 (0.48) CYP1A2SCN5AFYNMAPK14MKNK2
SCHEMBL20203731 0.80 CYP1A2 (0.49) CYP1A2SCN5AFYNMAPK14MKNK1
SCHEMBL26539431 0.80 CYP1A2 (0.54) CYP1A2SCN5AFYNCHEK1CHEK2
SCHEMBL20204036 0.79 CYP1A2 (0.54) CYP1A2SCN5AFYNMAPK14

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 8/4885FYN 1495/4885
US-20230322790-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B CYP1A2 1988/4885SCN5A 8/4885FYN 1495/4885

“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.