SCHEMBL19954374

SCHEMBL19954374

C=C(C)C(=O)OC1C2OC(=O)C3C2CC1[C@H]3C

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
HTT P42858 1/20 0.33
RECQL P46063 1/20 0.33
RAB9A P51151 1/20 0.33
ATM Q13315 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GPX4 P36969 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL685969 1.00 KDM4E (0.33) KDM4ENPC1POLBMAPTPKM
SCHEMBL18270550 0.90 KDM4E (0.34) KDM4ENPC1POLBMAPTPKM
SCHEMBL685683 0.87 ALDH1A1 (0.33)
SCHEMBL10204631 0.86 KDM4E (0.35) KDM4ENPC1POLBMAPTPKM
SCHEMBL13425003 0.86 TAS2R46 (0.35) NPC1MAPTHTTRAB9A
SCHEMBL13638263 0.86
SCHEMBL1216158 0.85 KDM4E (0.32) KDM4ENPC1POLBMAPTPKM
SCHEMBL1218941 0.85 KDM4E (0.32) KDM4ENPC1POLBMAPTPKM
SCHEMBL14489074 0.85 ALDH1A1 (0.32)
SCHEMBL6103191 0.85

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
US-9915870-B2 Pattern forming method, composition kit and resist film, and method for producing electronic device using them, and electronic device FUJIFILM CORPORATION (JP) 2018-03-13 US disclosed