SCHEMBL14557993

SCHEMBL14557993

CCCC(C)(C)c1ccc(S(=O)(=O)c2ccc(OC(C)(C)CC)c(S(=O)(=O)O)c2)cc1S(=O)(=O)O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ S1PR3 Q99500 1/20 0.31
▸ LMNA P02545 1/20 0.30
▸ HTT P42858 1/20 0.30

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
SCHEMBL14557891 0.88 POLB (0.32) POLBTSHR
SCHEMBL14557905 0.86 POLB (0.31) POLB
SCHEMBL14557992 0.85 ELANE (0.34) MAPK1TSHRLMNAHTT
SCHEMBL14546134 0.79 CASP1 (0.34) MAPK1POLBTSHR
SCHEMBL17814755 0.79 HSD11B1 (0.30) —
SCHEMBL14520413 0.78 MEN1 (0.36) POLBLMNA
SCHEMBL12807621 0.78 RRM1 (0.34) MAPK1POLBTSHR
SCHEMBL14546136 0.76 CASP1 (0.36) MAPK1POLBTSHR
SCHEMBL14557892 0.75 ELANE (0.34) MAPK1POLBLMNAHTT
SCHEMBL13573469 0.75 LMNA (0.39) MAPK1POLBTSHRLMNA

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-20070066759-A1 Block copolymers and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-03-22 — — US disclosed
Send feedback