SCHEMBL28045911

SCHEMBL28045911

Cc1cc(C)c(O)c(C2(O)C(=O)N(C(c3ccccc3)c3ccccc3)c3ccccc32)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.40
MAPT P10636 6/20 0.36
TP53 P04637 3/20 0.36
OPRM1 P35372 2/20 0.36
OPRD1 P41143 2/20 0.36
OPRK1 P41145 2/20 0.36
OPRL1 P41146 2/20 0.36
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
SLC6A4 P31645 2/20 0.34
HPGD P15428 2/20 0.34
MEN1 O00255 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
SLC6A2 P23975 1/20 0.34

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
SCHEMBL2305769 0.83 KMT2A (0.48) ALDH1A1SMN1; SMN2MAPTTP53OPRM1
SCHEMBL2306983 0.78 SCN9A (0.39) ALDH1A1SMN1; SMN2TP53OPRM1OPRD1
SCHEMBL15315022 0.76 ALDH1A1 (0.41) ALDH1A1SMN1; SMN2MAPTOPRM1OPRD1
SCHEMBL2306628 0.76 ALDH1A1 (0.37) ALDH1A1SMN1; SMN2MAPTOPRM1OPRD1
SCHEMBL385967 0.75 MEN1 (0.40) ALDH1A1SMN1; SMN2MAPTTP53OPRM1
SCHEMBL2305324 0.75 OPRM1 (0.39) ALDH1A1SMN1; SMN2OPRM1OPRD1OPRK1
SCHEMBL281494 0.75 OPRM1 (0.41) ALDH1A1SMN1; SMN2MAPTTP53OPRM1
SCHEMBL2305064 0.75 KMT2A (0.42) ALDH1A1SMN1; SMN2OPRM1OPRD1OPRK1
SCHEMBL3328359 0.74 SMN1; SMN2 (0.38) ALDH1A1SMN1; SMN2MAPTTP53OPRM1
SCHEMBL3327230 0.74 CBX7 (0.37) ALDH1A1SMN1; SMN2MAPTTSHRSLC6A4

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-103664973-B Spiro-oxindole compounds and their use as therapeutic agents 泽农医药公司 2017-04-19 CN disclosed
CN-102256983-B Spirooxindole compounds and their use as therapeutic agents 泽农医药公司 2017-04-05 CN disclosed
CN-105218565-A Spiral shell oxindole compounds and the purposes as therapeutical agent thereof XENON PHARMACEUTICALS INC 2016-01-06 CN disclosed
CN-105175433-A Spiro-oxindole compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC 2015-12-23 CN disclosed