SCHEMBL31510086

SCHEMBL31510086

CNc1ncccc1CN(CCC(F)(F)F)C(=O)OCCl

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 3/20 0.32
▸ KCNH2 Q12809 2/20 0.32
▸ SCN5A Q14524 2/20 0.32
▸ EPHX2 P34913 1/20 0.31
▸ BCHE P06276 1/20 0.31
▸ ACHE P22303 1/20 0.31
▸ SMN1; SMN2 Q16637 2/20 0.31
▸ HTT P42858 1/20 0.31
▸ SSTR4 P31391 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ TMEM97 Q5BJF2 1/20 0.31
▸ SIGMAR1 Q99720 1/20 0.31
▸ CYP1A2 P05177 2/20 0.31
▸ CYP3A4 P08684 2/20 0.31
▸ CYP2C19 P33261 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ CLK4 Q9HAZ1 1/20 0.31
▸ TDP2 O95551 1/20 0.31
▸ LPAR1 Q92633 1/20 0.31
▸ LPAR5 Q9H1C0 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
SCHEMBL31509910 0.86 HTT (0.37) SMN1; SMN2HTTKDM4ETMEM97SIGMAR1
SCHEMBL31509893 0.81 SSTR4 (0.31) SSTR4
SCHEMBL25213440 0.81 HTT (0.32) SMN1; SMN2HTTSSTR4
SCHEMBL30392867 0.81 HTT (0.32) SMN1; SMN2HTTSSTR4
SCHEMBL31509862 0.80 CYP1A2 (0.37) BCHEACHESMN1; SMN2HTTKDM4E
SCHEMBL31509735 0.77 L3MBTL1 (0.39) SMN1; SMN2HTTALDH1A1MAPK1
SCHEMBL31509777 0.70 NAMPT (0.31) HTT
SCHEMBL31411101 0.68 KDM4E (0.40) BCHEACHEKDM4ECYP1A2CYP2C19
SCHEMBL25683911 0.67 — —
SCHEMBL1066057 0.66 CASP3 (0.40) SMN1; SMN2HTTKDM4ECYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250127801-A1 BRIDGED TRICYCLIC CARBAMOYLPYRIDONE COMPOUNDS AND USES THEREOF GILEAD SCIENCES, INC. 2025-04-24 — — US disclosed
WO-2025080850-A1 BRIDGED TRICYCLIC CARBAMOYLPYRIDONE COMPOUNDS AND USES THEREOF GILEAD SCIENCES, INC. (US) 2025-04-17 — — 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-20250127801-A1 BRIDGED TRICYCLIC CARBAMOYLPYRIDONE COMPOUNDS AND USES THEREOF SDHA, SDHB, DPYD SCN9A 4244/4885KCNH2 2290/4885SCN5A 3763/4885

“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.

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