SCHEMBL8323322

SCHEMBL8323322

CC(C)(C)OC(=O)COc1ccc(-c2cccc(S)c2-c2ccc(OCC(=O)OC(C)(C)C)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.51
MAPT P10636 4/20 0.42
PSEN1 P49768 3/20 0.42
PSEN2 P49810 3/20 0.42
APH1B Q8WW43 3/20 0.42
NCSTN Q92542 3/20 0.42
APH1A Q96BI3 3/20 0.42
PSENEN Q9NZ42 3/20 0.42
LMNA P02545 2/20 0.39
NPC1 O15118 2/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
POLB P06746 1/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CTSK P43235 2/20 0.38

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
SCHEMBL8319098 0.94 PTPN1 (0.49) PTPN1MAPTPSEN1PSEN2APH1B
Trifluoromethanesulfonic Acid SCHEMBL8862142 0.91 PTPN1 (0.47) PTPN1MAPTPSEN1PSEN2APH1B
SCHEMBL8645080 0.88 PTPN1 (0.44) PTPN1MAPTPSEN1PSEN2APH1B
SCHEMBL8862185 0.88 PTPN1 (0.44) PTPN1MAPTPSEN1PSEN2APH1B
SCHEMBL8318362 0.85 PTPN1 (0.47) PTPN1MAPTPSEN1PSEN2APH1B
SCHEMBL28305621 0.81 PTPN1 (0.63) PTPN1MAPTLMNANPC1CASP3
SCHEMBL8319591 0.81 PTPN1 (0.45) PTPN1MAPTPSEN1PSEN2APH1B
SCHEMBL8322047 0.81 ELANE (0.54) PTPN1CYP2C9CYP2C19PPARGPPARA
SCHEMBL14652405 0.79 MAPT (0.53) PTPN1MAPTPSEN1PSEN2APH1B
SCHEMBL21794098 0.79 PTPN1 (0.52) PTPN1MAPTPSEN1PSEN2APH1B

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-5880169-A HAVING HIGH RESOLUTION FOR FINE PATTERNING SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-03-09 US disclosed