SCHEMBL20209010

SCHEMBL20209010

N#CC1(c2ccc(-c3cn4c(C(F)(F)F)ncc4cn3)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.54
SCN5A Q14524 1/20 0.40
FGFR1 P11362 2/20 0.35
FGFR4 P22455 2/20 0.35
MAP4K1 Q92918 1/20 0.34
OPRM1 P35372 3/20 0.34
MAP4K4 O95819 1/20 0.33
MLYCD O95822 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TNF P01375 1/20 0.32

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
SCHEMBL26462170 0.90 CYP1A2 (0.46) CYP1A2FGFR1FGFR4MAP4K1OPRM1
SCHEMBL20209244 0.87 SCN5A (0.55) CYP1A2SCN5AMAP4K1OPRM1MAP4K4
SCHEMBL20203933 0.84 CYP1A2 (0.64) CYP1A2SCN5A
SCHEMBL20203847 0.81 CYP1A2 (0.59) CYP1A2SCN5AFGFR1FGFR4MAP4K4
SCHEMBL20189522 0.80 CYP1A2 (0.50) CYP1A2SCN5AFGFR1FGFR4TNF
SCHEMBL20209245 0.79 CYP1A2 (0.51) CYP1A2SCN5AMAP4K1MAP4K4MLYCD
SCHEMBL26539127 0.77 CYP1A2 (0.55) CYP1A2SCN5AFGFR1FGFR4MAP4K1
SCHEMBL26462839 0.77 SCN5A (0.44) CYP1A2SCN5AMAP4K1OPRM1MAP4K4
SCHEMBL20209632 0.76 SCN5A (0.49) CYP1A2SCN5AALDH1A1
SCHEMBL26539147 0.76 CYP1A2 (0.53) CYP1A2SCN5AFGFR1FGFR4OPRM1

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-20230134428-A1 FUSED HETEROARYL COMPOUNDS, AND METHODS THEREOF FOR TREATING DISEASES, DISORDERS, AND CONDITIONS RELATING TO ABERRANT FUNCTION OF A SODIUM CHANNEL PRAXIS PRECISION MEDICINES, INC. 2023-05-04 US disclosed
US-20230134428-A1 FUSED HETEROARYL COMPOUNDS, AND METHODS THEREOF FOR TREATING DISEASES, DISORDERS, AND CONDITIONS RELATING TO ABERRANT FUNCTION OF A SODIUM CHANNEL PRAXIS PRECISION MEDICINES, INC. 2023-05-04 US disclosed
WO-2018098491-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 (1 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-20230134428-A1 FUSED HETEROARYL COMPOUNDS, AND METHODS THEREOF FOR TREATING DISEASES, DISORDERS, AND CONDITIONS RELATING TO ABERRANT FUNCTION OF A SODIUM CHANNEL SCN1A, SCN3A, SCN2A CYP1A2 3251/4885SCN5A 7/4885FGFR1 1916/4885

“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.