SCHEMBL13656146

SCHEMBL13656146

CCC(C)(C)C(=O)NC(=O)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.39
RIPK1 Q13546 4/20 0.39
CA2 P00918 2/20 0.39
POLB P06746 2/20 0.38
ALDH1A1 P00352 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
LMNA P02545 1/20 0.34
CA3 P07451 2/20 0.33
CA5A P35218 2/20 0.33
CA5B Q9Y2D0 2/20 0.33
CA14 Q9ULX7 2/20 0.33
GAA P10253 1/20 0.33
THRB P10828 1/20 0.33
HTT P42858 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CA12 O43570 1/20 0.33
CA4 P22748 1/20 0.33
CA6 P23280 1/20 0.33

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
SCHEMBL14428590 0.88 RIPK1 (0.45) RIPK1POLBALDH1A1MEN1KMT2A
SCHEMBL14997672 0.81 RIPK1 (0.41) RIPK1POLBALDH1A1SMN1; SMN2MEN1
SCHEMBL15045366 0.79 RIPK1 (0.40) RIPK1POLBALDH1A1LMNAGAA
SCHEMBL20100303 0.78 RIPK1 (0.38) EPHX1RIPK1POLBALDH1A1LMNA
SCHEMBL2053132 0.77 CA2 (0.59) EPHX1CA2POLBALDH1A1SMN1; SMN2
SCHEMBL12017039 0.76 RIPK1 (0.41) EPHX1RIPK1CA2POLBALDH1A1
SCHEMBL14838796 0.76 RIPK1 (0.46) RIPK1POLBALDH1A1LMNAGAA
SCHEMBL14477917 0.75 CA2 (0.46) EPHX1CA2POLBALDH1A1SMN1; SMN2
SCHEMBL14997673 0.74 RIPK1 (0.40) RIPK1POLBALDH1A1SMN1; SMN2MEN1
SCHEMBL14612345 0.73 RIPK1 (0.39) EPHX1RIPK1POLBALDH1A1MEN1

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-20090246481-A1 DISPERSION OF WATER-INSOLUBLE COLORANT, METHOD OF PRODUCING SUBSTANCE CONTAINING WATER-INSOLUBLE COLORANT, FINE PARTICLES OF WATER-INSOLUBLE COLORANT, DISPERSING AGENT FOR WATER-INSOLUBLE COLORANT, AND RECORDING LIQUID, INK SET, PRINTED ARTICLE, METHOD OF FORMING IMAGE AND IMAGE FORMING APPARATUS USING THE SAME FUJIFILM CORPORATION (JP) 2009-10-01 US disclosed