SCHEMBL28607233

SCHEMBL28607233

CC(C)(C)OC(=O)NOC(=O)C1CCC(O)CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.39
KMT2A Q03164 4/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 2/20 0.38
TSHR P16473 1/20 0.38
CTSK P43235 2/20 0.36
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
GAA P10253 1/20 0.35
EPHX1 P07099 1/20 0.34
CA12 O43570 2/20 0.33
HRH3 Q9Y5N1 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
CA14 Q9ULX7 1/20 0.33

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
SCHEMBL2540692 0.93 BTK (0.42) BTKKMT2AALDH1A1MEN1TSHR
SCHEMBL4961405 0.90 BTK (0.40) BTKKMT2AALDH1A1MEN1TSHR
SCHEMBL1771267 0.86 BTK (0.51) BTKKMT2AALDH1A1MEN1TSHR
SCHEMBL4706132 0.86 BTK (0.47) BTKKMT2AALDH1A1MEN1TSHR
SCHEMBL3918859 0.85 BTK (0.46) BTKKMT2AALDH1A1MEN1TSHR
SCHEMBL28558390 0.82 BTK (0.42) BTKKMT2AALDH1A1MEN1TSHR
SCHEMBL27914275 0.82 BTK (0.38) BTKKMT2AALDH1A1MEN1TSHR
SCHEMBL28749381 0.82 BTK (0.38) BTKKMT2AALDH1A1MEN1TSHR
SCHEMBL15881327 0.82 RECQL (0.39) BTKKMT2AALDH1A1MEN1TSHR
SCHEMBL1282302 0.81 MEN1 (0.45) BTKKMT2AALDH1A1MEN1TSHR

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
CN-113152115-B Medical orthopedic bandage and preparation method thereof 宁波因天之序生物科技有限公司 2023-08-04 CN claimed
CN-113152115-A Medical orthopedic bandage and preparation method thereof 宁波因天之序生物科技有限公司 2021-07-23 CN claimed
CN-113152115-B Medical orthopedic bandage and preparation method thereof 宁波因天之序生物科技有限公司 2023-08-04 CN disclosed
CN-113152115-A Medical orthopedic bandage and preparation method thereof 宁波因天之序生物科技有限公司 2021-07-23 CN disclosed