SCHEMBL20203863

SCHEMBL20203863

FC(F)(F)Cc1nnc2ccc(Cl)nn12

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.58
KDM4E B2RXH2 4/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
CYP1A2 P05177 2/20 0.53
MET P08581 2/20 0.44
DYRK1A Q13627 3/20 0.39
DYRK2 Q92630 3/20 0.39
DYRK1B Q9Y463 2/20 0.36
CCNA2 P20248 1/20 0.36
CDK2 P24941 1/20 0.36
CDK5 Q00535 1/20 0.36
CDK5R1 Q15078 1/20 0.36
MAPK14 Q16539 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
GRM2 Q14416 3/20 0.34
TNF P01375 1/20 0.33

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
SCHEMBL2420906 0.77 KDM4E (0.58) ALDH1A1KDM4ESMN1; SMN2METDYRK1A
SCHEMBL31735817 0.77 KDM4E (0.58) ALDH1A1KDM4ESMN1; SMN2METDYRK1A
SCHEMBL2267586 0.75 ALDH1A1 (0.75) ALDH1A1KDM4ESMN1; SMN2CYP1A2DYRK1A
SCHEMBL23116158 0.75 KDM4E (0.55) ALDH1A1KDM4ESMN1; SMN2CYP1A2MET
SCHEMBL750158 0.74 ALDH1A1 (1.00) ALDH1A1KDM4ESMN1; SMN2CYP1A2DYRK1A
SCHEMBL2263427 0.73 HTT (0.64) SMN1; SMN2CYP1A2METCDK2MEN1
SCHEMBL31601848 0.72 DYRK1A (0.51) ALDH1A1KDM4ESMN1; SMN2DYRK1ADYRK2
SCHEMBL24155930 0.72 KDM4E (0.51) ALDH1A1KDM4ESMN1; SMN2CYP1A2MET
SCHEMBL2695540 0.72 KDM4E (0.47) ALDH1A1KDM4ESMN1; SMN2METKMT2A
SCHEMBL22744857 0.71 ALDH1A1 (0.75) ALDH1A1KDM4ESMN1; SMN2CYP1A2DYRK1A

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 ALDH1A1 916/4885KDM4E 2066/4885SMN1; SMN2 334/4885
US-20230322790-A1 COMPOUNDS AND THEIR METHODS OF USE SCN1A, SCN3A, SCN1B ALDH1A1 916/4885KDM4E 2066/4885SMN1; SMN2 334/4885

“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.