SCHEMBL25036786

SCHEMBL25036786

CCc1c(N2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c(=O)n2nc(C3=CCOCC3)nc2n1CC(=O)Nc1ccc(C(F)(F)F)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ WRN Q14191 1/20 0.54
▸ TRPV1 Q8NER1 3/20 0.34
▸ HDAC1 Q13547 1/20 0.32
▸ MAPT P10636 4/20 0.32
▸ PIK3CA P42336 1/20 0.31
▸ MTOR P42345 1/20 0.31
▸ MAP4K4 O95819 1/20 0.31
▸ LMNA P02545 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ ESR2 Q92731 1/20 0.31
▸ EIF2AK4 Q9P2K8 1/20 0.31
▸ NOD2 Q9HC29 1/20 0.30
▸ NOD1 Q9Y239 1/20 0.30
▸ MCHR1 Q99705 1/20 0.30
▸ NR1H2 P55055 1/20 0.30
▸ NR1H3 Q13133 1/20 0.30
▸ GPR119 Q8TDV5 2/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ CA1 P00915 1/20 0.30

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
SCHEMBL30039230 0.97 WRN (0.52) WRNTRPV1HDAC1
SCHEMBL30038300 0.96 WRN (0.51) WRNTRPV1
SCHEMBL25035193 0.93 WRN (0.47) WRNTRPV1HDAC1MAPTPIK3CA
SCHEMBL25037094 0.91 WRN (0.67) WRNHDAC1MAPTLMNAALDH1A1
SCHEMBL30037643 0.91 WRN (0.67) WRNHDAC1MAPTLMNAALDH1A1
SCHEMBL25035182 0.91 WRN (0.61) WRNMAPTMTORLMNAALDH1A1
SCHEMBL30037683 0.90 WRN (0.45) WRNTRPV1HDAC1MAPTPIK3CA
SCHEMBL30038998 0.88 WRN (0.58) WRNMAPTPIK3CAMTORLMNA
SCHEMBL30038140 0.88 WRN (0.58) WRNMAPTPIK3CAMTORLMNA
SCHEMBL25037205 0.87 WRN (0.56) WRNMAPTPIK3CAMTORLMNA

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-20240360118-A1 Bicyclic Compounds and their Uses NOVARTIS PHARMA AG (CH) 2024-10-31 — — US disclosed
US-11878973-B2 Bicyclic compounds and their uses NOVARTIS AG (CH) 2024-01-23 — — US disclosed
US-20230046859-A1 Bicyclic Compounds and their Uses NOVARTIS PHARMA AG (CH) 2023-02-16 — — US disclosed
US-20230046859-A1 Bicyclic Compounds and their Uses NOVARTIS PHARMA AG (CH) 2023-02-16 — — US 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 (3 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-20240360118-A1 Bicyclic Compounds and their Uses H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, C1R, F12 WRN 1829/4885TRPV1 1055/4885HDAC1 571/4885
US-11878973-B2 Bicyclic compounds and their uses H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, C1R, F12 WRN 1829/4885TRPV1 1055/4885HDAC1 571/4885
US-20230046859-A1 Bicyclic Compounds and their Uses H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, C1R, F12 WRN 1829/4885TRPV1 1055/4885HDAC1 571/4885

“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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