SCHEMBL28809795

SCHEMBL28809795

CCOc1ccc(C(=O)c2ccccc2C(C)C)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.56
KDM4E B2RXH2 4/20 0.56
HPGD P15428 3/20 0.56
ALOX15 P16050 2/20 0.56
ALDH1A1 P00352 1/20 0.56
RECQL P46063 1/20 0.56
HSD17B10 Q99714 1/20 0.56
KMT2A Q03164 3/20 0.54
NPSR1 Q6W5P4 3/20 0.54
LMNA P02545 5/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
MAPK1 P28482 2/20 0.54
PLK1 P53350 1/20 0.53
NPC1 O15118 4/20 0.52
RAB9A P51151 3/20 0.52
TSHR P16473 1/20 0.52
HCRTR1 O43613 1/20 0.52
HCRTR2 O43614 1/20 0.52
PARP10 Q53GL7 1/20 0.51
MEN1 O00255 2/20 0.51

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
SCHEMBL15214042 0.84 KMT2A (0.64) MAPTKDM4EHPGDALDH1A1KMT2A
SCHEMBL11576385 0.83 MAPT (0.57) MAPTKDM4EHPGDALOX15ALDH1A1
SCHEMBL11755151 0.83 LMNA (0.67) MAPTKDM4EHPGDALOX15ALDH1A1
SCHEMBL31527717 0.83 LMNA (0.67) MAPTKDM4EHPGDALOX15ALDH1A1
SCHEMBL30763327 0.81 KMT2A (0.69) MAPTKDM4EHPGDALOX15ALDH1A1
SCHEMBL9712621 0.81 MAPT (0.56) MAPTKDM4EHPGDALOX15ALDH1A1
SCHEMBL10372218 0.81 MAPT (0.59) MAPTKDM4EHPGDALOX15ALDH1A1
SCHEMBL11576796 0.80 MAPT (0.66) MAPTKDM4EHPGDALOX15ALDH1A1
SCHEMBL845256 0.80 L3MBTL1 (0.77) MAPTHPGDALDH1A1KMT2ANPSR1
SCHEMBL1122739 0.79 BCL2 (0.64) MAPTALDH1A1KMT2ALMNAL3MBTL1

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-114727934-A Wound debridement system 雷杰尼斯有限公司 2022-07-08 CN disclosed