SCHEMBL22277481

SCHEMBL22277481

CC(C)(C)OC(=O)N1CCC(C(C)(C)OC(=O)c2cc(I)cc(I)c2O)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.41
KDM4E B2RXH2 1/20 0.41
THRB P10828 1/20 0.41
GPR119 Q8TDV5 9/20 0.40
PTPN2 P17706 1/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39
HPGD P15428 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 2/20 0.38
STS P08842 1/20 0.38
EED O75530 1/20 0.37
RBBP4 Q09028 1/20 0.37
SUZ12 Q15022 1/20 0.37
EZH2 Q15910 1/20 0.37
AEBP2 Q6ZN18 1/20 0.37
NPC1 O15118 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL22277450 0.90 MAPT (0.42) MAPTKDM4ETHRBGPR119PTPN2
SCHEMBL22277478 0.86 MAPT (0.39) MAPTKDM4ETHRBGPR119PTPN2
SCHEMBL22277482 0.83 DPP4 (0.37) MAPTKDM4ETHRBGPR119PTPN2
SCHEMBL22277386 0.81 GPR119 (0.50) KDM4EGPR119PTPN2PTPN1PTPN6
SCHEMBL22277447 0.80 TTR (0.35)
SCHEMBL24179407 0.80 DPP4 (0.35) MAPTKDM4ETHRBGPR119PTPN2
SCHEMBL22277387 0.78 GPR119 (0.49) KDM4EGPR119PTPN2PTPN1PTPN6
SCHEMBL27397892 0.78 TTR (0.48) THRBMEN1KMT2AMAPK1HTT
SCHEMBL30289413 0.78 TTR (0.48) THRBMEN1KMT2AMAPK1HTT
SCHEMBL22277407 0.76 MEN1 (0.47) MAPTKDM4ETHRBGPR119PTPN2

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-20200241417-A1 RESIST COMPOSITION AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-07-30 US disclosed