SCHEMBL20203798

SCHEMBL20203798

Fc1cc(-c2cn3c(C(F)(F)F)nnc3cn2)cnc1OC1CC(F)(F)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 9/20 1.00
ACACB O00763 3/20 0.34
SCN5A Q14524 8/20 0.33
SCN1A P35498 1/20 0.31
SCN2A Q99250 1/20 0.31

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
SCHEMBL23116229 0.92 CYP1A2 (0.85) CYP1A2ACACB
SCHEMBL26539187 0.92 CYP1A2 (0.85) CYP1A2ACACB
SCHEMBL31339061 0.92 CYP1A2 (0.85) CYP1A2ACACB
SCHEMBL23116177 0.91 CYP1A2 (0.82) CYP1A2ACACB
SCHEMBL30884080 0.91 CYP1A2 (0.82) CYP1A2ACACB
SCHEMBL23116260 0.88 CYP1A2 (0.78) CYP1A2ACACB
SCHEMBL22711895 0.86 CYP1A2 (0.76) CYP1A2SCN5ASCN1ASCN2A
SCHEMBL22712083 0.86 CYP1A2 (0.76) CYP1A2SCN5ASCN1ASCN2A
SCHEMBL22711945 0.86 CYP1A2 (0.76) CYP1A2SCN5ASCN1ASCN2A
SCHEMBL34468368 0.86 CYP1A2 (0.76) 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 3 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-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 1988/4885ACACB 814/4885SCN5A 8/4885
US-20230322790-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B CYP1A2 1988/4885ACACB 814/4885SCN5A 8/4885

“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.