SCHEMBL25815393

SCHEMBL25815393

C#CCN(C(=O)OC(C)(C)C)c1ccc(C(=O)OC)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.45
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
TSHR P16473 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
NPC1 O15118 1/20 0.40
GAA P10253 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ELANE P08246 1/20 0.39
KCNQ4 P56696 1/20 0.39
KCNQ5 Q9NR82 1/20 0.39
MAPT P10636 3/20 0.39
HDAC1 Q13547 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
CA1 P00915 3/20 0.38
CA2 P00918 3/20 0.38
TDP1 Q9NUW8 1/20 0.38
CA12 O43570 1/20 0.38

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
SCHEMBL31363214 0.86 KCNQ4 (0.38) NPC1KCNQ4KCNQ5MAPTCA1
SCHEMBL31363319 0.86 PLK1 (0.39) TSHRSMN1; SMN2HPGDKCNQ4KCNQ5
SCHEMBL4838149 0.83 NOTUM (0.49) NOTUMALDH1A1KDM4ETSHRSMN1; SMN2
SCHEMBL31738374 0.83 KCNQ4 (0.39) SMN1; SMN2MAPK1KCNQ4KCNQ5MEN1
SCHEMBL30148761 0.83 KCNQ4 (0.39) KCNQ4KCNQ5
SCHEMBL31738257 0.83 CA12 (0.44) NOTUMALDH1A1KDM4EGAAHPGD
SCHEMBL1624928 0.82 NOTUM (0.48) NOTUMALDH1A1KDM4ETSHRSMN1; SMN2
SCHEMBL15180119 0.82 ALDH1A1 (0.44) NOTUMALDH1A1KDM4ETSHRSMN1; SMN2
SCHEMBL23113822 0.82 MEN1 (0.45) ALDH1A1TSHRSMN1; SMN2KCNQ4KCNQ5
SCHEMBL9246608 0.82 MAPK1 (0.42) KDM4EMAPK1KCNQ4KCNQ5HDAC1

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
WO-2025059074-A1 BICYCLIC COMPOUNDS FOR RESTORING MUTANT P53 FUNCTION PMV PHARMACEUTICALS, INC. (US) 2025-03-20 WO disclosed
WO-2023122298-A1 PROTEIN STABILIZING COMPOUNDS CONTAINING USP28 AND/OR USP25 TARGETING LIGANDS Stablix, Inc. (US) 2023-06-29 WO disclosed