SCHEMBL25736747

SCHEMBL25736747

CC(S)C(=O)OC1CCC(NC(=O)OC(C)(C)C)CC1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.43
KDM1A O60341 1/20 0.41
MAOB P27338 1/20 0.41
CTSK P43235 2/20 0.41
HSD11B1 P28845 2/20 0.40
CYP2C9 P11712 1/20 0.40
GAA P10253 2/20 0.40
EPHX1 P07099 3/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
DRD2 P14416 2/20 0.37
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
NFKB1 P19838 3/20 0.36
NFKB2 Q00653 3/20 0.36
RELA Q04206 3/20 0.36

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
SCHEMBL25736751 0.92 BTK (0.48) BTKKDM1AMAOBCTSKHSD11B1
SCHEMBL25736746 0.84 BTK (0.56) BTKKDM1AMAOBCTSKHSD11B1
SCHEMBL17392661 0.80 BTK (0.49) BTKKDM1AMAOBCTSKHSD11B1
SCHEMBL10434311 0.80 BTK (0.53) BTKKDM1AMAOBCTSKHSD11B1
SCHEMBL15325976 0.80 BTK (0.49) BTKKDM1AMAOBCTSKHSD11B1
SCHEMBL7423460 0.80 BTK (0.49) BTKKDM1AMAOBCTSKHSD11B1
SCHEMBL3702157 0.79 BTK (0.61) BTKKDM1AMAOBCTSKHSD11B1
SCHEMBL10343938 0.79 BTK (0.61) BTKKDM1AMAOBCTSKHSD11B1
SCHEMBL3702152 0.79 BTK (0.61) BTKKDM1AMAOBCTSKHSD11B1
SCHEMBL1406894 0.79 BTK (0.61) BTKKDM1AMAOBCTSKHSD11B1

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-20230152698-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-18 US disclosed
US-20230152698-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-18 US disclosed