SCHEMBL19612286

SCHEMBL19612286

CCCCOc1ccc2cc(Cl)c(OCCCC)cc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA3 P07451 1/20 0.45
CA4 P22748 1/20 0.45
CA6 P23280 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
CA14 Q9ULX7 1/20 0.45
CA5B Q9Y2D0 1/20 0.45
ALDH1A1 P00352 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KCNH2 Q12809 1/20 0.43
KDM4E B2RXH2 1/20 0.43
BACE1 P56817 1/20 0.42
CYSLTR2 Q9NS75 1/20 0.41
CYSLTR1 Q9Y271 1/20 0.41

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
SCHEMBL19612299 1.00 GLA (0.47) GLASMN1; SMN2CA12CA1CA2
SCHEMBL19612236 0.95 NR5A1 (0.46) GLASMN1; SMN2CA12CA1CA2
SCHEMBL17912819 0.95 NR5A1 (0.46) GLASMN1; SMN2CA12CA1CA2
SCHEMBL17912835 0.83 NQO1 (0.45) SMN1; SMN2CA12CA1CA4CA6
SCHEMBL17912805 0.83 NQO1 (0.45) SMN1; SMN2CA12CA1CA4CA6
SCHEMBL3790208 0.82 KDM4E (0.51) GLASMN1; SMN2CA12CA1CA2
SCHEMBL3785500 0.82 SMN1; SMN2 (0.59) GLASMN1; SMN2ALDH1A1TDP1L3MBTL1
SCHEMBL29919785 0.82 CA12 (0.56) CA12CA1CA2CA3CA4
SCHEMBL15772990 0.82 CA12 (0.56) CA12CA1CA2CA3CA4
SCHEMBL347009 0.82 CA12 (0.56) CA12CA1CA2CA3CA4

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-20170336728-A1 ULTRAVIOLET CURABLE LIQUID COMPOSITION, ULTRAVIOLET CURING INKJET INK, ULTRAVIOLET CURING WET ELECTROPHOTOGRAPHIC LIQUID DEVELOPER, ULTRAVIOLET CURING ELECTROSTATIC INKJET INK, AND IMAGE FORMING METHOD USING THEREOF CANON KABUSHIKI KAISHA (JP) 2017-11-23 US disclosed