SCHEMBL8318362

SCHEMBL8318362

CC(C)(C)OC(=O)COc1cccc(-c2cccc(S)c2-c2cccc(OCC(=O)OC(C)(C)C)c2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.47
MAPT P10636 2/20 0.41
LMNA P02545 2/20 0.41
POLB P06746 1/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
FABP4 P15090 6/20 0.40
FABP5 Q01469 4/20 0.40
FABP3 P05413 2/20 0.40
CTSK P43235 2/20 0.40
OPRK1 P41145 1/20 0.39
PSEN1 P49768 2/20 0.39
PSEN2 P49810 2/20 0.39
APH1B Q8WW43 2/20 0.39
NCSTN Q92542 2/20 0.39
APH1A Q96BI3 2/20 0.39
PSENEN Q9NZ42 2/20 0.39
FABP1 P07148 1/20 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
SCHEMBL8319591 0.94 PTPN1 (0.45) PTPN1MAPTLMNAPOLBCYP2C9
SCHEMBL8646704 0.89 PTPN1 (0.43) PTPN1MAPTLMNAPOLBCYP2C9
SCHEMBL8644654 0.88 PTPN1 (0.41) PTPN1MAPTLMNAPOLBCYP2C9
SCHEMBL8323322 0.85 PTPN1 (0.51) PTPN1MAPTLMNAPOLBCYP2C9
SCHEMBL8322205 0.81 ELANE (0.44) PTGS2RXRARXRB
SCHEMBL8319098 0.81 PTPN1 (0.49) PTPN1MAPTLMNAPOLBCYP2C9
SCHEMBL17024452 0.79 LMNA (0.53) PTPN1MAPTLMNAPOLBCYP2C9
Trifluoromethanesulfonic Acid SCHEMBL8862142 0.78 PTPN1 (0.47) PTPN1MAPTLMNAPOLBCYP2C9
SCHEMBL8325002 0.77 ELANE (0.40) PTGS2PTPRCRXRARXRB
SCHEMBL244495 0.76 KDM4E (0.40) HPGDNPSR1RXRARXRBMEN1

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