SCHEMBL21835686

SCHEMBL21835686

COCc1cc(OC(F)(F)F)ccc1-c1cnc(Cl)cn1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 6/20 0.58
ALOX5AP P20292 3/20 0.42
FEN1 P39748 3/20 0.42
CHRM5 P08912 3/20 0.38
CBFB Q13951 1/20 0.38
P2RY1 P47900 1/20 0.37
GPR3 P46089 2/20 0.35
DYRK1A Q13627 1/20 0.35
FFAR4 Q5NUL3 1/20 0.34
F2RL3 Q96RI0 1/20 0.34
GRM2 Q14416 1/20 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
SCHEMBL21835708 0.89 CYP1A2 (0.47) CYP1A2ALOX5APFEN1CHRM5CBFB
SCHEMBL21835679 0.88 CYP1A2 (0.44) CYP1A2ALOX5APFEN1CHRM5P2RY1
SCHEMBL21835681 0.84 CYP1A2 (0.42) CYP1A2ALOX5APFEN1CHRM5P2RY1
SCHEMBL21835668 0.82 CYP1A2 (0.55) CYP1A2ALOX5APFEN1CBFBGPR3
SCHEMBL21835698 0.81 CYP1A2 (0.54) CYP1A2ALOX5APFEN1CHRM5P2RY1
SCHEMBL21835707 0.77 ALOX5AP (0.44) CYP1A2ALOX5APFEN1CHRM5CBFB
SCHEMBL21835654 0.77 CYP1A2 (0.49) CYP1A2ALOX5APFEN1CBFB
SCHEMBL31733962 0.77 CYP1A2 (0.49) CYP1A2ALOX5APFEN1CBFB
SCHEMBL20190641 0.75 CYP1A2 (0.66) CYP1A2ALOX5APFEN1CBFBDYRK1A
SCHEMBL20209012 0.75 CYP1A2 (0.74) CYP1A2ALOX5APFEN1CBFBDYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12479844-B2 Ion channel modulators PRAXIS PRECISION MEDICINES, INC. (US) 2025-11-25 US disclosed
US-20210403476-A1 ION CHANNEL MODULATORS PRAXIS PRECISION MEDICINES, INC. 2021-12-30 US disclosed
US-20210403476-A1 ION CHANNEL MODULATORS PRAXIS PRECISION MEDICINES, INC. 2021-12-30 US disclosed
EP-3856193-A1 ION CHANNEL MODULATORS Praxis Precision Medicines, Inc. (US) 2021-08-04 EP disclosed
WO-2020069322-A1 ION CHANNEL MODULATORS PRAXIS PRECISION MEDICINES, INC. (US) 2020-04-02 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-20210403476-A1 ION CHANNEL MODULATORS SCN1A, SCN3A, SCN2A CYP1A2 2873/4885ALOX5AP 1210/4885FEN1 4819/4885
US-12479844-B2 Ion channel modulators SCN1A, SCN3A, SCN2A CYP1A2 2873/4885ALOX5AP 1210/4885FEN1 4819/4885

“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.