SCHEMBL9750154

SCHEMBL9750154

CCCCCc1cc(S(=O)(=O)c2cc(CCCCC)c(O)c(CCCCC)c2)cc(CCCCC)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 6/20 0.47
PTGS2 P35354 7/20 0.46
MEN1 O00255 3/20 0.43
HTT P42858 3/20 0.43
KMT2A Q03164 3/20 0.43
TYR P14679 2/20 0.43
CYP3A4 P08684 2/20 0.43
MAPT P10636 2/20 0.43
TP53 P04637 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
CA2 P00918 1/20 0.40
ELANE P08246 2/20 0.39
CTSG P08311 2/20 0.39
TRPV1 Q8NER1 1/20 0.39
EGFR P00533 1/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 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
SCHEMBL5382807 0.81 CA2 (0.43) ALOX5MEN1HTTKMT2ATYR
SCHEMBL8610020 0.81 POLB (0.53) ALOX5MEN1HTTKMT2ATYR
SCHEMBL2363780 0.81 POLB (0.53) ALOX5MEN1HTTKMT2ATYR
SCHEMBL5374401 0.80 CA2 (0.42) ALOX5MEN1HTTKMT2ATYR
SCHEMBL258494 0.80 GABRA1 (0.46) CYP3A4MAPTALOX15TSHRCA2
SCHEMBL8971610 0.78 ALOX5 (0.70) ALOX5PTGS2MEN1HTTKMT2A
SCHEMBL8588879 0.76 PTGS2 (0.71) ALOX5PTGS2MEN1HTTKMT2A
SCHEMBL127023 0.76 PTGS2 (0.71) ALOX5PTGS2MEN1HTTKMT2A
SCHEMBL1160403 0.76 PTGS2 (0.63) ALOX5PTGS2HTTCYP3A4TP53
SCHEMBL8367626 0.76 PTGS2 (0.71) ALOX5PTGS2MEN1HTTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5084593-A Cyanine, aniline dyes for heat sensitive recording elements RICOH COMPANY, LTD. (JP) 1992-01-28 US disclosed
US-5008238-A Thermosensitive material with phenolic developer RICOH COMPANY, LTD. (JP) 1991-04-16 US disclosed