SCHEMBL2308046

SCHEMBL2308046

OCCc1ccc2c(c1)Sc1ccc(CCO)cc1S2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
ALOX5 P09917 1/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
BACE1 P56817 1/20 0.50
CA2 P00918 2/20 0.44
TDP1 Q9NUW8 1/20 0.41
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CA5B Q9Y2D0 1/20 0.36
TSHR P16473 1/20 0.36
CYP4F2 P78329 5/20 0.35
CYP4A11 Q02928 5/20 0.35

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
SCHEMBL2308138 1.00 KDM4E (0.50) KDM4EALDH1A1ALOX5GAAMAPT
SCHEMBL2307240 0.94 TDP1 (0.46) KDM4EALDH1A1ALOX5GAAMAPT
SCHEMBL2307233 0.83 ALOX5 (0.37) KDM4EALDH1A1ALOX5GAAMAPT
SCHEMBL2307378 0.83 ALOX5 (0.37) KDM4EALDH1A1ALOX5GAAMAPT
SCHEMBL31083563 0.81 HSD17B10 (0.37) CA2CA12CA4CA6CA5A
SCHEMBL31083668 0.81 HSD17B10 (0.37) CA2CA12CA4CA6CA5A
SCHEMBL2314300 0.81 GAA (0.45) KDM4EALDH1A1ALOX5GAAMAPT
SCHEMBL2311509 0.74 NOX1 (0.57) ALDH1A1GAAMAPTTDP1TSHR
SCHEMBL2312864 0.74 NOX1 (0.57) KDM4EALDH1A1ALOX5GAAMAPT
SCHEMBL10515069 0.73 TDP1 (0.38) KDM4EALDH1A1ALOX5GAAMAPT

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-7989517-B2 Actinic ray curable composition, actinic ray curable ink, and image formation process employing the same KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2011-08-02 US disclosed
US-20070123600-A1 ACTINIC RAY CURABLE COMPOSITION, ACTINIC RAY CURABLE INK, AND IMAGE FORMATION PROCESS EMPLOYING THE SAME KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-05-31 US disclosed