SCHEMBL20203703

SCHEMBL20203703

Fc1cc(-c2ccc3nnc(C(F)F)n3n2)cnc1OCC(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 8/20 0.50
MET P08581 5/20 0.38
PDE1A P54750 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
PDE3B Q13370 1/20 0.38
PDE1C Q14123 1/20 0.38
PDE3A Q14432 1/20 0.38
PDE11A Q9HCR9 1/20 0.38
PDE10A Q9Y233 1/20 0.38
SCN5A Q14524 1/20 0.37
DGAT1 O75907 1/20 0.36
CYP3A4 P08684 2/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GABRA1 P14867 1/20 0.35
HPGD P15428 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA5 P31644 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
SCHEMBL26539183 0.92 CYP1A2 (0.48) CYP1A2METPDE1APDE4CPDE4D
SCHEMBL20203751 0.86 CYP1A2 (0.68) CYP1A2METSCN5ADGAT1ALDH1A1
SCHEMBL22744821 0.84 CYP1A2 (0.46) CYP1A2METPDE1APDE4CPDE4D
SCHEMBL22744852 0.84 CYP1A2 (0.46) CYP1A2METPDE1APDE4CPDE4D
SCHEMBL23571625 0.84 CYP1A2 (0.46) CYP1A2METPDE1APDE4CPDE4D
SCHEMBL22711883 0.83 CYP1A2 (0.48) CYP1A2METPDE1APDE4CPDE4D
SCHEMBL20203852 0.83 CYP1A2 (0.56) CYP1A2METSCN5ADGAT1CYP3A4
SCHEMBL20204023 0.83 CYP1A2 (0.58) CYP1A2METSCN5ADGAT1KDM4E
SCHEMBL23116072 0.83 CYP1A2 (0.50) CYP1A2METCYP3A4
SCHEMBL26539275 0.83 CYP1A2 (0.58) CYP1A2METSCN5ADGAT1CYP3A4

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 1988/4885MET 3724/4885PDE1A 374/4885
US-20230322790-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B CYP1A2 1988/4885MET 3724/4885PDE1A 374/4885

“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.