SCHEMBL16281925

SCHEMBL16281925

CC(C)(C)Oc1ccc(Oc2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.63
MAPT P10636 4/20 0.63
ALDH1A1 P00352 4/20 0.63
NPC1 O15118 3/20 0.63
HPGD P15428 3/20 0.63
MAPK1 P28482 2/20 0.63
KDM4E B2RXH2 2/20 0.44
POLB P06746 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 2/20 0.41
TYR P14679 1/20 0.41
FGFR2 P21802 1/20 0.41
TRPV1 Q8NER1 2/20 0.40
GAA P10253 1/20 0.40
TDP1 Q9NUW8 3/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL21782373 1.00 RAB9A (0.63) RAB9AMAPTALDH1A1NPC1HPGD
SCHEMBL22883647 0.94 RAB9A (0.57) RAB9AMAPTALDH1A1NPC1HPGD
SCHEMBL85686 0.93 MAPT (0.52) RAB9AMAPTALDH1A1NPC1HPGD
SCHEMBL18807772 0.89 RAB9A (0.52) RAB9AMAPTALDH1A1NPC1HPGD
SCHEMBL18807773 0.89 RAB9A (0.52) RAB9AMAPTALDH1A1NPC1HPGD
SCHEMBL18807837 0.89 RAB9A (0.52) RAB9AMAPTALDH1A1NPC1HPGD
SCHEMBL20468036 0.89 RAB9A (0.52) RAB9AMAPTALDH1A1NPC1HPGD
SCHEMBL18807766 0.89 RAB9A (0.52) RAB9AMAPTALDH1A1NPC1HPGD
SCHEMBL18807878 0.89 RAB9A (0.52) RAB9AMAPTALDH1A1NPC1HPGD
SCHEMBL427816 0.88 RAB9A (0.77) RAB9AMAPTALDH1A1NPC1HPGD

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9782767-B2 Sulfonate-based compound and polymer electrolyte membrane using same LG CHEM, LTD. (KR) 2017-10-10 US disclosed
US-9782767-B2 Sulfonate-based compound and polymer electrolyte membrane using same LG CHEM, LTD. (KR) 2017-10-10 US disclosed
US-9614242-B2 Polymer electrolyte composition, electrolyte membrane, membrane-electrode assembly and fuel cell LG CHEM, LTD. (KR) 2017-04-04 US disclosed
US-9614242-B2 Polymer electrolyte composition, electrolyte membrane, membrane-electrode assembly and fuel cell LG CHEM, LTD. (KR) 2017-04-04 US disclosed
US-9486422-B2 Small molecule inhibitors of Mcl-1 and the uses of thereof THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2016-11-08 US disclosed
US-20150328630-A1 SULFONATE-BASED COMPOUND AND POLYMER ELECTROLYTE MEMBRANE USING SAME LG CHEM, LTD. (KR) 2015-11-19 US disclosed
US-20140363754-A1 POLYMER ELECTROLYTE COMPOSITION, ELECTROLYTE MEMBRANE, MEMBRANE-ELECTRODE ASSEMBLY AND FUEL CELL LG CHEM, LTD. (KR) 2014-12-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150328630-A1 SULFONATE-BASED COMPOUND AND POLYMER ELECTROLYTE MEMBRANE USING SAME STOM, EPCAM, PTDSS2 RAB9A 2278/4885MAPT 2562/4885ALDH1A1 2719/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.