SCHEMBL28337694

SCHEMBL28337694

CC(C)(C)OC(=O)C(CCNC(=O)OCc1ccccc1)N1C(=O)CCC1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.51
FOLH1 Q04609 2/20 0.49
ABCB1 P08183 1/20 0.47
SYK P43405 1/20 0.47
LMNA P02545 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KLK7 P49862 2/20 0.46
KLK5 Q9Y337 2/20 0.46
SLC1A3 P43003 1/20 0.46
SLC1A1 P43005 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
HTT P42858 1/20 0.44
GAA P10253 1/20 0.43
ALDH1A1 P00352 1/20 0.43
PKM P14618 1/20 0.43
DPP8 Q6V1X1 1/20 0.43
DPP7 Q9UHL4 1/20 0.43
TPSAB1 Q15661 1/20 0.42
TPSD1 Q9BZJ3 1/20 0.42
TPSG1 Q9NRR2 1/20 0.42

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
SCHEMBL28613212 0.87 FOLH1 (0.51) MAPTFOLH1LMNASMN1; SMN2SLC1A3
SCHEMBL29025643 0.81 MAPT (0.54) MAPTFOLH1ABCB1SYKLMNA
SCHEMBL26902832 0.81 MAPT (0.54) MAPTFOLH1ABCB1SYKLMNA
SCHEMBL30613463 0.81 MAPT (0.54) MAPTFOLH1ABCB1SYKLMNA
SCHEMBL7941702 0.79 MAPT (0.55) MAPTFOLH1ABCB1SYKLMNA
SCHEMBL12972610 0.79 FOLH1 (0.53) MAPTFOLH1ABCB1KLK7KLK5
SCHEMBL18145642 0.79 FOLH1 (0.70) MAPTFOLH1ABCB1KLK7KLK5
SCHEMBL14719943 0.79 FOLH1 (0.70) MAPTFOLH1ABCB1KLK7KLK5
SCHEMBL16269959 0.78 MAPT (0.53) MAPTFOLH1ABCB1SYKLMNA
SCHEMBL16269962 0.78 SYK (0.58) MAPTABCB1SYKLMNASMN1; SMN2

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
CN-110621673-A Double-stranded linked cytotoxic drug conjugates 杭州多禧生物科技有限公司 2019-12-27 CN disclosed