SCHEMBL24977966

SCHEMBL24977966

Cc1c(C(F)(F)F)nc2c(c1C(C)(C)C)CCC2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
MAPT P10636 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
KDM4E B2RXH2 4/20 0.34
USP2 O75604 1/20 0.34
HSD17B10 Q99714 3/20 0.33
MAPK1 P28482 3/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
TSHR P16473 2/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 2/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MEN1 O00255 1/20 0.32
ACHE P22303 1/20 0.32
BPTF Q12830 1/20 0.32
NOS3 P29474 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
SCHEMBL22019708 0.82 SMN1; SMN2 (0.46) SMN1; SMN2L3MBTL1MAPTTDP1KDM4E
SCHEMBL24977970 0.81 MAPT (0.31) SMN1; SMN2L3MBTL1MAPTTDP1
SCHEMBL24978541 0.80 SMN1; SMN2 (0.39) SMN1; SMN2L3MBTL1MAPTTDP1KDM4E
SCHEMBL22020516 0.78 MAPT (0.39) SMN1; SMN2L3MBTL1MAPTTDP1KDM4E
SCHEMBL22010514 0.78 ACHE (0.50) SMN1; SMN2L3MBTL1KDM4EMAPK1ALDH1A1
SCHEMBL30162576 0.78 ACHE (0.50) SMN1; SMN2L3MBTL1KDM4EMAPK1ALDH1A1
SCHEMBL22019995 0.76 ACHE (0.48) SMN1; SMN2L3MBTL1MAPTTDP1KDM4E
SCHEMBL24977994 0.75 SMN1; SMN2 (0.41) SMN1; SMN2L3MBTL1MAPTTDP1KDM4E
SCHEMBL22020099 0.75 SMN1; SMN2 (0.41) SMN1; SMN2L3MBTL1MAPTKDM4EUSP2
SCHEMBL22019782 0.75 SMN1; SMN2 (0.41) SMN1; SMN2L3MBTL1MAPTTDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230031406-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-02-02 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 (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-20230031406-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 SMN1; SMN2 2608/4885L3MBTL1 4789/4885MAPT 2020/4885

“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.