SCHEMBL8320382

SCHEMBL8320382

CCOC(C)Oc1cccc(S(OS(C)(=O)=O)(c2ccccc2)c2cccc(OC(C)OCC)c2)c1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 6/20 0.39
HSD11B1 P28845 1/20 0.36
ALDH1A1 P00352 4/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
TAS2R14 Q9NYV8 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.32
STS P08842 1/20 0.32
PSIP1 O75475 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32

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
SCHEMBL8317351 0.89 ADAMTS4 (0.32) KAT6AALDH1A1SMN1; SMN2LMNA
SCHEMBL8322202 0.88 MAPT (0.38) ALDH1A1LMNAPSIP1CYP1A2CYP2C9
SCHEMBL20885297 0.74 LMNA (0.44) ALDH1A1SMN1; SMN2LMNA
SCHEMBL8322917 0.73 PGR (0.35) KAT6AHSD11B1ALDH1A1KEAP1NFE2L2
SCHEMBL21828862 0.73 KMT2A (0.56) SMN1; SMN2CYP2C9
SCHEMBL997422 0.72 LMNA (0.46) ALDH1A1LMNACYP1A2CYP2C9CYP2C19
SCHEMBL8320379 0.72 KAT6A (0.34) KAT6AALDH1A1SMN1; SMN2
SCHEMBL207124 0.72 HTR6 (0.46) ALDH1A1KEAP1SMN1; SMN2LMNAPSIP1
SCHEMBL8325000 0.70 ELANE (0.40) KAT6AHSD11B1ALDH1A1STSCYP2C9
SCHEMBL8319587 0.70 PSEN1 (0.42) KAT6AHSD11B1LMNACYP2C9CYP2C19

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