SCHEMBL25209429

SCHEMBL25209429

NNC(=O)c1cc(OC(F)(F)F)ccc1F

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.53
▸ GAA P10253 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ ABL1 P00519 2/20 0.49
▸ BRAF P15056 1/20 0.46
▸ PIM1 P11309 1/20 0.44
▸ LCLAT1 Q6UWP7 1/20 0.44
▸ FFAR1 O14842 2/20 0.44
▸ FFAR4 Q5NUL3 2/20 0.44
▸ SCN9A Q15858 3/20 0.43
▸ IGF2BP2 Q9Y6M1 1/20 0.43
▸ TRPV1 Q8NER1 1/20 0.43
▸ EPHX2 P34913 1/20 0.42
▸ MAPT P10636 2/20 0.42
▸ KCNK2 O95069 1/20 0.41
▸ KCNK10 P57789 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ MITF O75030 1/20 0.41
▸ NCOA1 Q15788 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41

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
Trifluoroacetic Acid SCHEMBL30473945 0.94 KDM4E (0.49) KDM4EGAAKMT2AABL1BRAF
SCHEMBL14968582 0.84 SCN9A (0.53) GAAABL1BRAFLCLAT1SCN9A
SCHEMBL25213511 0.83 ALDH1A1 (0.57) KDM4EGAAKMT2AABL1PIM1
SCHEMBL25211630 0.83 GAA (0.52) KDM4EGAAKMT2APIM1IGF2BP2
SCHEMBL1795070 0.82 ALDH1A1 (0.44) ABL1BRAFPIM1LCLAT1FFAR1
SCHEMBL30468358 0.82 CHEK1 (0.47) KDM4EGAAKMT2AABL1BRAF
SCHEMBL13407882 0.82 CHEK1 (0.47) KDM4EGAAKMT2AABL1BRAF
SCHEMBL25240945 0.82 ABL1 (0.47) KDM4EABL1BRAFLCLAT1FFAR1
SCHEMBL25213585 0.81 CA1 (0.54) KDM4EGAAKMT2AMAPTMEN1
SCHEMBL17478821 0.81 ABL1 (0.45) KDM4EKMT2AABL1BRAFLCLAT1

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
CN-118302422-A Substituted N-cyanopyrrolidines having activity as USP30 inhibitors 特殊治疗有限公司 2024-07-05 — — CN disclosed
WO-2023099561-A1 SUBSTITUTED N-CYANOPYRROLIDINES WITH ACTIVITY AS USP30 INHIBITORS MISSION THERAPEUTICS LIMITED (GB) 2023-06-08 — — WO disclosed
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